Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LGF19R
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| Ligand Name |
(13alpha,18alpha)-2-Cyano-3-Hydroxy-12-Oxooleana-2,9(11)-Dien-28-Oic Acid
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| Synonyms |
(13alpha,18alpha)-2-Cyano-3-Hydroxy-12-Oxooleana-2,9(11)-Dien-28-Oic Acid; Q27465538
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| Structure |
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Download2D MOL |
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| Formula |
C31H43NO4
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| Canonical SMILES |
CC1(CCC2(CCC3(C(C2C1)C(=O)C=C4C3(CCC5C4(CC(=C(C5(C)C)O)C#N)C)C)C)C(=O)O)C
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| InChI |
1S/C31H43NO4/c1-26(2)10-12-31(25(35)36)13-11-30(7)23(19(31)16-26)20(33)14-22-28(5)15-18(17-32)24(34)27(3,4)21(28)8-9-29(22,30)6/h14,19,21,23,34H,8-13,15-16H2,1-7H3,(H,35,36)/t19-,21-,23-,28-,29+,30+,31-/m0/s1
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| InChIKey |
YTXFWWUYCLBPKV-UQMAOPSPSA-N
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| PubChem Compound ID | ||||
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