(Q105196232)

English

(10R,13R)-17-(5-hydroxy-5-propan-2-ylhept-6-en-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

group of stereoisomers with the chemical formula C₂₉H₄₈O₂

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Statements

group of stereoisomers

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stigmastan-type steroid

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stigmastan-type steroid

428.365430776 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₉H₄₈O₂

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canonical SMILES

OC1CC2=CCC3C(CCC4(C)C(CCC34)C(C)CCC(O)(C=C)C(C)C)C2(C)CC1

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isomeric SMILES

C=CC(O)(CCC(C)C1CCC2C3CC=C4CC(O)CC[C@]4(C)C3CC[C@]12C)C(C)C

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Identifiers

InChI=1S/C29H48O2/c1-7-29(31,19(2)3)17-12-20(4)24-10-11-25-23-9-8-21-18-22(30)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-8,19-20,22-26,30-31H,1,9-18H2,2-6H3/t20?,22?,23?,24?,25?,26?,27-,28+,29?/m0/s1

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OPGVEUGCNGNPSX-XLEBFAQBSA-N

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1 reference

based on heuristic

inferred from InChIKey

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