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  1. 1 - 30
Compound 11
Drug synonym:Not Available
Molecular Weight:332.285
Molecular Formula:C15H8O7S
SMILES:OC(=O)C1=CC2=C(C=C1)C(=O)C1=C(C=C(C=C1)S(O)(=O)=O)C2=O
InChI:1S/C15H8O7S/c16-13-9-3-1-7(15(18)19)5-11(9)14(17)12-6-8(23(20,21)22)2-4-10(12)13/h1-6H,(H,18,19)(H,20,21,22)
InChIKey:DADSVSLNUAUJSY-UHFFFAOYSA-N
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Compound 16
Drug synonym:Not Available
Molecular Weight:400.382
Molecular Formula:Not Available
SMILES:OS(=O)(=O)C1=CC2=C(C=C1)C(=O)C1=C(C=C(C=C1)C(=O)NCCCC(*)=O)C2=O
InChI:Not Available
InChIKey:Not Available
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Compound 1
Drug synonym:Not Available
Molecular Weight:238.2381
Molecular Formula:C15H10O3
SMILES:OCC1=CC2=C(C=C1)C(=O)C1=C(C=CC=C1)C2=O
InChI:1S/C15H10O3/c16-8-9-5-6-12-13(7-9)15(18)11-4-2-1-3-10(11)14(12)17/h1-7,16H,8H2
InChIKey:JYKHAJGLEVKEAA-UHFFFAOYSA-N
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Compound 2
Drug synonym:Not Available
Molecular Weight:483.479
Molecular Formula:Not Available
SMILES:FC(F)(F)C(*)C1=CC=CC(CSCC(=O)OCC2=CC3=C(C=C2)C(=O)C2=C(C=CC=C2)C3=O)=C1
InChI:Not Available
InChIKey:Not Available
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Compound 4
Drug synonym:Not Available
Molecular Weight:444.499
Molecular Formula:C26H20O5S
SMILES:O=C(CCCC(=O)SC1=CC=CC=C1)OCC1=CC2=C(C=C1)C(=O)C1=C(C=CC=C1)C2=O
InChI:1S/C26H20O5S/c27-23(11-6-12-24(28)32-18-7-2-1-3-8-18)31-16-17-13-14-21-22(15-17)26(30)20-10-5-4-9-19(20)25(21)29/h1-5,7-10,13-15H,6,11-12,16H2
InChIKey:ZZKBTAJIRCXXIE-UHFFFAOYSA-N
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Compound 5
Drug synonym:Not Available
Molecular Weight:429.488
Molecular Formula:C25H19NO4S
SMILES:O=C(CCCNC(=O)C1=CC2=C(C=C1)C(=O)C1=C(C=CC=C1)C2=O)SC1=CC=CC=C1
InChI:1S/C25H19NO4S/c27-22(31-17-7-2-1-3-8-17)11-6-14-26-25(30)16-12-13-20-21(15-16)24(29)19-10-5-4-9-18(19)23(20)28/h1-5,7-10,12-13,15H,6,11,14H2,(H,26,30)
InChIKey:XZEMDHSFJNXWMZ-UHFFFAOYSA-N
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Compound 6
Drug synonym:Not Available
Molecular Weight:473.5173
Molecular Formula:C21H35N3O9
SMILES:CN(CCC(=O)NCCOCCOCCO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)C1=CC=NC=C1
InChI:1S/C21H35N3O9/c1-24(15-2-5-22-6-3-15)8-4-17(26)23-7-9-30-10-11-31-12-13-32-21-20(29)19(28)18(27)16(14-25)33-21/h2-3,5-6,16,18-21,25,27-29H,4,7-14H2,1H3,(H,23,26)/t16-,18-,19+,20+,21+/m1/s1
InChIKey:XNUFVRDFHHHSPQ-TZMRYXNNSA-N
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Compound 7
Drug synonym:Not Available
Molecular Weight:Not Available
Molecular Formula:Not Available
SMILES:Not Available
InChI:Not Available
InChIKey:Not Available
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Compound 8
Drug synonym:Not Available
Molecular Weight:Not Available
Molecular Formula:Not Available
SMILES:Not Available
InChI:Not Available
InChIKey:Not Available
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Compound 9
Drug synonym:Not Available
Molecular Weight:509.551
Molecular Formula:C25H19NO7S2
SMILES:OS(=O)(=O)C1=CC2=C(C=C1)C(=O)C1=C(C=CC(=C1)C(=O)NCCCC(=O)SC1=CC=CC=C1)C2=O
InChI:1S/C25H19NO7S2/c27-22(34-16-5-2-1-3-6-16)7-4-12-26-25(30)15-8-10-18-20(13-15)23(28)19-11-9-17(35(31,32)33)14-21(19)24(18)29/h1-3,5-6,8-11,13-14H,4,7,12H2,(H,26,30)(H,31,32,33)
InChIKey:WBMCBJLTTXPPNP-UHFFFAOYSA-N
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Compound 10
Drug synonym:Not Available
Molecular Weight:252.2216
Molecular Formula:C15H8O4
SMILES:OC(=O)C1=CC2=C(C=C1)C(=O)C1=C(C=CC=C1)C2=O
InChI:1S/C15H8O4/c16-13-9-3-1-2-4-10(9)14(17)12-7-8(15(18)19)5-6-11(12)13/h1-7H,(H,18,19)
InChIKey:ASDLSKCKYGVMAI-UHFFFAOYSA-N
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Compound 12
Drug synonym:Not Available
Molecular Weight:159.2261
Molecular Formula:C8H17NO2
SMILES:CC(C)(C)OC(=O)CCCN
InChI:1S/C8H17NO2/c1-8(2,3)11-7(10)5-4-6-9/h4-6,9H2,1-3H3
InChIKey:XFZZZOMHBHBURH-UHFFFAOYSA-N
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Compound 13
Drug synonym:Not Available
Molecular Weight:473.496
Molecular Formula:C23H23NO8S
SMILES:CC(C)(C)OC(=O)CCCNC(=O)C1=CC2=C(C=C1)C(=O)C1=C(C=C(C=C1)S(O)(=O)=O)C2=O
InChI:1S/C23H23NO8S/c1-23(2,3)32-19(25)5-4-10-24-22(28)13-6-8-15-17(11-13)21(27)18-12-14(33(29,30)31)7-9-16(18)20(15)26/h6-9,11-12H,4-5,10H2,1-3H3,(H,24,28)(H,29,30,31)
InChIKey:LUZHPVHRIUJXKK-UHFFFAOYSA-N
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Compound 14
Drug synonym:Not Available
Molecular Weight:417.389
Molecular Formula:C19H15NO8S
SMILES:OC(=O)CCCNC(=O)C1=CC2=C(C=C1)C(=O)C1=C(C=C(C=C1)S(O)(=O)=O)C2=O
InChI:1S/C19H15NO8S/c21-16(22)2-1-7-20-19(25)10-3-5-12-14(8-10)18(24)15-9-11(29(26,27)28)4-6-13(15)17(12)23/h3-6,8-9H,1-2,7H2,(H,20,25)(H,21,22)(H,26,27,28)
InChIKey:LHZDFSJAWFBADK-UHFFFAOYSA-N
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Compound 15
Drug synonym:Not Available
Molecular Weight:110.177
Molecular Formula:C6H6S
SMILES:SC1=CC=CC=C1
InChI:1S/C6H6S/c7-6-4-2-1-3-5-6/h1-5,7H
InChIKey:RMVRSNDYEFQCLF-UHFFFAOYSA-N
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Compound 27
Drug synonym:Not Available
Molecular Weight:635.6579
Molecular Formula:C27H45N3O14
SMILES:CN(CCC(=O)NCCOCCOCCO[C@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O)C1=CC=NC=C1
InChI:1S/C27H45N3O14/c1-30(16-2-5-28-6-3-16)8-4-19(32)29-7-9-39-10-11-40-12-13-41-26-24(37)23(36)21(34)18(44-26)15-42-27-25(38)22(35)20(33)17(14-31)43-27/h2-3,5-6,17-18,20-27,31,33-38H,4,7-15H2,1H3,(H,29,32)/t17-,18-,20-,21-,22+,23+,24+,25+,26+,27+/m1/s1
InChIKey:SNAIHCQLAJPDHK-ASRZKXJJSA-N
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Compound 18
Drug synonym:Not Available
Molecular Weight:337.3263
Molecular Formula:C12H23N3O8
SMILES:OC[C@H]1O[C@H](OCCOCCOCCN=[N+]=[N-])[C@@H](O)[C@@H](O)[C@@H]1O
InChI:1S/C12H23N3O8/c13-15-14-1-2-20-3-4-21-5-6-22-12-11(19)10(18)9(17)8(7-16)23-12/h8-12,16-19H,1-7H2/t8-,9-,10+,11+,12+/m1/s1
InChIKey:ABBZTEUICIJBPU-GCHJQGSQSA-N
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Compound 19
Drug synonym:Not Available
Molecular Weight:575.7259
Molecular Formula:C28H41N3O8Si
SMILES:[H]O[C@@H]1[C@@H](CO[Si](C2=CC=CC=C2)(C2=CC=CC=C2)C(C)(C)C)O[C@H](OCCOCCOCCN=[N+]=[N-])[C@@H](O[H])[C@H]1O[H]
InChI:1S/C28H41N3O8Si/c1-28(2,3)40(21-10-6-4-7-11-21,22-12-8-5-9-13-22)38-20-23-24(32)25(33)26(34)27(39-23)37-19-18-36-17-16-35-15-14-30-31-29/h4-13,23-27,32-34H,14-20H2,1-3H3/t23-,24-,25+,26+,27+/m1/s1
InChIKey:MKJPCKTVDAPZSG-VKINHPFQSA-N
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Compound 20
Drug synonym:Not Available
Molecular Weight:888.0441
Molecular Formula:C49H53N3O11Si
SMILES:CC(C)(C)[Si](OC[C@H]1O[C@H](OCCOCCOCCN=[N+]=[N-])[C@@H](OC(=O)C2=CC=CC=C2)[C@@H](OC(=O)C2=CC=CC=C2)[C@@H]1OC(=O)C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
InChI:1S/C49H53N3O11Si/c1-49(2,3)64(39-25-15-7-16-26-39,40-27-17-8-18-28-40)59-35-41-42(61-45(53)36-19-9-4-10-20-36)43(62-46(54)37-21-11-5-12-22-37)44(63-47(55)38-23-13-6-14-24-38)48(60-41)58-34-33-57-32-31-56-30-29-51-52-50/h4-28,41-44,48H,29-35H2,1-3H3/t41-,42-,43+,44+,48+/m1/s1
InChIKey:CXJCBSDEXGPGKY-RMJYEZIKSA-N
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Compound 21
Drug synonym:Not Available
Molecular Weight:649.6445
Molecular Formula:C33H35N3O11
SMILES:OC[C@H]1O[C@H](OCCOCCOCCN=[N+]=[N-])[C@@H](OC(=O)C2=CC=CC=C2)[C@@H](OC(=O)C2=CC=CC=C2)[C@@H]1OC(=O)C1=CC=CC=C1
InChI:1S/C33H35N3O11/c34-36-35-16-17-41-18-19-42-20-21-43-33-29(47-32(40)25-14-8-3-9-15-25)28(46-31(39)24-12-6-2-7-13-24)27(26(22-37)44-33)45-30(38)23-10-4-1-5-11-23/h1-15,26-29,33,37H,16-22H2/t26-,27-,28+,29+,33+/m1/s1
InChIKey:GCDPAZFBFPFTGM-NZXJAAMGSA-N
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Compound 22
Drug synonym:Not Available
Molecular Weight:659.477
Molecular Formula:C34H27BrO9
SMILES:Br[C@H]1O[C@H](COC(=O)C2=CC=CC=C2)[C@@H](OC(=O)C2=CC=CC=C2)[C@H](OC(=O)C2=CC=CC=C2)[C@@H]1OC(=O)C1=CC=CC=C1
InChI:1S/C34H27BrO9/c35-30-29(44-34(39)25-19-11-4-12-20-25)28(43-33(38)24-17-9-3-10-18-24)27(42-32(37)23-15-7-2-8-16-23)26(41-30)21-40-31(36)22-13-5-1-6-14-22/h1-20,26-30H,21H2/t26-,27-,28+,29+,30+/m1/s1
InChIKey:WISFGQOOKBVKPD-ZNOUKXQUSA-N
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Compound 23
Drug synonym:Not Available
Molecular Weight:1228.2094
Molecular Formula:C67H61N3O20
SMILES:[N-]=[N+]=NCCOCCOCCO[C@H]1O[C@H](CO[C@H]2O[C@H](COC(=O)C3=CC=CC=C3)[C@@H](OC(=O)C3=CC=CC=C3)[C@H](OC(=O)C3=CC=CC=C3)[C@@H]2OC(=O)C2=CC=CC=C2)[C@@H](OC(=O)C2=CC=CC=C2)[C@H](OC(=O)C2=CC=CC=C2)[C@@H]1OC(=O)C1=CC=CC=C1
InChI:1S/C67H61N3O20/c68-70-69-36-37-78-38-39-79-40-41-80-66-57(89-64(76)49-32-18-6-19-33-49)55(87-62(74)47-28-14-4-15-29-47)54(86-61(73)46-26-12-3-13-27-46)52(83-66)43-82-67-58(90-65(77)50-34-20-7-21-35-50)56(88-63(75)48-30-16-5-17-31-48)53(85-60(72)45-24-10-2-11-25-45)51(84-67)42-81-59(71)44-22-8-1-9-23-44/h1-35,51-58,66-67H,36-43H2/t51-,52-,53-,54-,55+,56+,57+,58+,66+,67+/m1/s1
InChIKey:OYAOESUFSHZFFC-XWWZUFNFSA-N
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Compound 24
Drug synonym:Not Available
Molecular Weight:1202.2118
Molecular Formula:C67H63NO20
SMILES:NCCOCCOCCO[C@H]1O[C@H](CO[C@H]2O[C@H](COC(=O)C3=CC=CC=C3)[C@@H](OC(=O)C3=CC=CC=C3)[C@H](OC(=O)C3=CC=CC=C3)[C@@H]2OC(=O)C2=CC=CC=C2)[C@@H](OC(=O)C2=CC=CC=C2)[C@H](OC(=O)C2=CC=CC=C2)[C@@H]1OC(=O)C1=CC=CC=C1
InChI:1S/C67H63NO20/c68-36-37-76-38-39-77-40-41-78-66-57(87-64(74)49-32-18-6-19-33-49)55(85-62(72)47-28-14-4-15-29-47)54(84-61(71)46-26-12-3-13-27-46)52(81-66)43-80-67-58(88-65(75)50-34-20-7-21-35-50)56(86-63(73)48-30-16-5-17-31-48)53(83-60(70)45-24-10-2-11-25-45)51(82-67)42-79-59(69)44-22-8-1-9-23-44/h1-35,51-58,66-67H,36-43,68H2/t51-,52-,53-,54-,55+,56+,57+,58+,66+,67+/m1/s1
InChIKey:BQRDAJCXLDEUID-XWWZUFNFSA-N
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Compound 25
Drug synonym:Not Available
Molecular Weight:180.2038
Molecular Formula:C9H12N2O2
SMILES:CN(CCC(O)=O)C1=CC=NC=C1
InChI:1S/C9H12N2O2/c1-11(7-4-9(12)13)8-2-5-10-6-3-8/h2-3,5-6H,4,7H2,1H3,(H,12,13)
InChIKey:VMRJOYCQTCCSEC-UHFFFAOYSA-N
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Compound 26
Drug synonym:Not Available
Molecular Weight:1364.4003
Molecular Formula:C76H73N3O21
SMILES:CN(CCC(=O)NCCOCCOCCO[C@H]1O[C@H](CO[C@H]2O[C@H](COC(=O)C3=CC=CC=C3)[C@@H](OC(=O)C3=CC=CC=C3)[C@H](OC(=O)C3=CC=CC=C3)[C@@H]2OC(=O)C2=CC=CC=C2)[C@@H](OC(=O)C2=CC=CC=C2)[C@H](OC(=O)C2=CC=CC=C2)[C@@H]1OC(=O)C1=CC=CC=C1)C1=CC=NC=C1
InChI:1S/C76H73N3O21/c1-79(58-37-40-77-41-38-58)43-39-61(80)78-42-44-88-45-46-89-47-48-90-75-66(99-73(86)56-33-19-7-20-34-56)64(97-71(84)54-29-15-5-16-30-54)63(96-70(83)53-27-13-4-14-28-53)60(93-75)50-92-76-67(100-74(87)57-35-21-8-22-36-57)65(98-72(85)55-31-17-6-18-32-55)62(95-69(82)52-25-11-3-12-26-52)59(94-76)49-91-68(81)51-23-9-2-10-24-51/h2-38,40-41,59-60,62-67,75-76H,39,42-50H2,1H3,(H,78,80)/t59-,60-,62-,63-,64+,65+,66+,67+,75+,76+/m1/s1
InChIKey:FFJLLLSAGISOFX-JYWVJSHUSA-N
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Compound 28
Drug synonym:Not Available
Molecular Weight:342.2965
Molecular Formula:C12H22O11
SMILES:OC[C@H]1O[C@H](OC[C@H]2OC(O)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O
InChI:1S/C12H22O11/c13-1-3-5(14)8(17)10(19)12(23-3)21-2-4-6(15)7(16)9(18)11(20)22-4/h3-20H,1-2H2/t3-,4-,5-,6-,7+,8+,9+,10+,11?,12+/m1/s1
InChIKey:DLRVVLDZNNYCBX-FZFXURTHSA-N
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Compound 29
Drug synonym:Not Available
Molecular Weight:342.2965
Molecular Formula:C12H22O11
SMILES:OC[C@H]1OC(O)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](O)[C@@H]1O
InChI:1S/C12H22O11/c13-1-3-6(16)8(18)10(11(20)21-3)23-12-9(19)7(17)5(15)4(2-14)22-12/h3-20H,1-2H2/t3-,4-,5-,6-,7+,8+,9+,10+,11?,12-/m1/s1
InChIKey:HIWPGCMGAMJNRG-VXSGSMIHSA-N
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Compound 30
Drug synonym:Not Available
Molecular Weight:342.2965
Molecular Formula:C12H22O11
SMILES:OC[C@H]1O[C@H](O[C@@H]2[C@H](O)C(O)O[C@H](CO)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O
InChI:1S/C12H22O11/c13-1-3-5(15)7(17)8(18)12(22-3)23-10-6(16)4(2-14)21-11(20)9(10)19/h3-20H,1-2H2/t3-,4-,5-,6-,7+,8+,9+,10+,11?,12-/m1/s1
InChIKey:QIGJYVCQYDKYDW-VXSGSMIHSA-N
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Compound 31
Drug synonym:Not Available
Molecular Weight:342.2965
Molecular Formula:C12H22O11
SMILES:OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)C(O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O
InChI:1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5-,6+,7-,8-,9-,10-,11?,12-/m1/s1
InChIKey:GUBGYTABKSRVRQ-PICCSMPSSA-N
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Compound 32
Drug synonym:Not Available
Molecular Weight:342.2965
Molecular Formula:C12H22O11
SMILES:OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)C(O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O
InChI:1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5+,6+,7-,8-,9-,10-,11?,12+/m1/s1
InChIKey:GUBGYTABKSRVRQ-QKKXKWKRSA-N
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