Representations & DB's id
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| ChEBI: |
None
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| ChEMBL: |
CHEMBL3401950
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| PubChem: |
118728786
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IUPAC:
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(2Z)-2-[(3R,4S,5S,6R,7R,8S,9S,10R,13R,14S,16S)-7,16-diacetyloxy-3,6-dihydroxy-4,8,10,14-tetramethyl-2,3,4,5,6,7,9,11,12,13,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-ylidene]-6-methylhept-5-enoic acid
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Standard InChI:
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InChI=1S/C33H50O8/c1-17(2)10-9-11-21(30(38)39)26-22-12-13-25-31(6)15-14-23(36)18(3)27(31)28(37)29(41-20(5)35)33(25,8)32(22,7)16-24(26)40-19(4)34/h10,18,22-25,27-29,36-37H,9,11-16H2,1-8H3,(H,38,39)/b26-21-/t18-,22+,23-,24+,25+,27-,28-,29+,31-,32+,33-/m1/s1
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Standard InChI Key:
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GDJVSKALKNUTRX-VALXSNPUSA-N
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SMILES:
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CC(=O)O[C@H]1C[C@]2([C@H](/C/1=C(/C(=O)O)CCC=C(C)C)CC[C@@H]1[C@]2(C)[C@@H](OC(=O)C)[C@H](O)[C@@H]2[C@]1(C)CC[C@H]([C@H]2C)O)C |
