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Molecular Formula: C30H49NO3
Molecular weight: 471.71496
InChi: InChI=1S/C30H49NO3/c1-19(2)21-11-15-30(26(33)34-7)17-16-28(5)23(25(21)30)9-10-24-27(4,13-8-18-31)22(20(3)32)12-14-29(24,28)6/h19-25,32H,8-17H2,1-7H3/t20-,21-,22-,23+,24+,25+,27-,28+,29+,30-/m0/s1
InChi Key: GJWRARXHXWKFRH-VCYWUFRLSA-N
SMILES: [C@@]12([C@]3([C@@H]([C@]([C@@H](CC3)[C@@H](O)C)(CCC#N)C)CC[C@@H]1[C@@H]1[C@](CC2)(C(=O)OC)CC[C@H]1C(C)C)C)C
Chemical Name
28-methyl ester, 3-nitrile of (4S)-4-hydroxy-24-nor-3,4-secolupane-3,28-dioic acid
External Links
PubChem