(Q105181087)

English

2,3-Dihydroxy-17-(6-hydroxy-6-methylheptan-2-yl)-10,13-dimethyl-1,2,3,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-6-one

group of stereoisomers with the chemical formula C₂₇H₄₂O₄

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Statements

group of stereoisomers

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cholestane steroid

1 reference

cholestane steroid

430.3083098239999 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₇H₄₂O₄

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canonical SMILES

O=C1C=C2C(CCC3(C)C2CCC3C(C)CCCC(O)(C)C)C4(C1=CC(O)C(O)C4)C

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Identifiers

InChI=1S/C27H42O4/c1-16(7-6-11-25(2,3)31)18-8-9-19-17-13-22(28)21-14-23(29)24(30)15-27(21,5)20(17)10-12-26(18,19)4/h13-14,16,18-20,23-24,29-31H,6-12,15H2,1-5H3

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NKTPHQGGTBBIOB-UHFFFAOYSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

NKTPHQGGTBBIOB-UHFFFAOYSA-N

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