Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L52VKB
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| Ligand Name |
Methyl 3-{4-[({[(9as)-8-Acetyl-1,7-Dihydroxy-3-Methoxy-9a-Methyl-9-Oxo-9,9a-Dihydrodibenzo[b,D]furan-4-Yl]carbonyl}amino)methyl]naphthalen-2-Yl}propanoate
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| Synonyms |
Methyl 3-{4-[({[(9as)-8-Acetyl-1,7-Dihydroxy-3-Methoxy-9a-Methyl-9-Oxo-9,9a-Dihydrodibenzo[b,D]furan-4-Yl]carbonyl}amino)methyl]naphthalen-2-Yl}propanoate; SCHEMBL3268799; Q27452638; 21L; Methyl 3-{4-[({[(9aS)-8-acetyl-1,7-dihydroxy-3-methoxy-9a-methyl-9-oxo-9,9a-dihydrodibenzo[b,d]furan-4-yl]carbonyl}amino)methyl]-2-naphthyl}propanoate
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| Structure |
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Download2D MOL |
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| Formula |
C32H29NO9
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| Canonical SMILES |
CC(=O)C1=C(C=C2C(C1=O)(C3=C(O2)C(=C(C=C3O)OC)C(=O)NCC4=CC(=CC5=CC=CC=C54)CCC(=O)OC)C)O
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| InChI |
1S/C32H29NO9/c1-16(34)26-21(35)14-24-32(2,30(26)38)28-22(36)13-23(40-3)27(29(28)42-24)31(39)33-15-19-12-17(9-10-25(37)41-4)11-18-7-5-6-8-20(18)19/h5-8,11-14,35-36H,9-10,15H2,1-4H3,(H,33,39)/t32-/m1/s1
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| InChIKey |
BLDDPMYSIQFXOT-JGCGQSQUSA-N
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| PubChem Compound ID | ||||
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