(Q104976431)

English

(1R,3aS,3bR,9aS,9bS,11aR)-1-[(2R)-5,6-dimethylheptan-2-yl]-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthren-7-one

group of stereoisomers with the chemical formula C₂₈H₄₈O

In more languages

Statements

group of stereoisomers

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ergostane steroid

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ergostane steroid

400.370516156 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₈H₄₈O

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canonical SMILES

O=C1CCC2(C)C(C1)CCC3C4CCC(C(C)CCC(C)C(C)C)C4(C)CCC32

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isomeric SMILES

CC(C)C(C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C

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Identifiers

InChI=1S/C28H48O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h18-21,23-26H,7-17H2,1-6H3/t19?,20-,21?,23+,24-,25+,26+,27+,28-/m1/s1

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DDJMOMHMVFXEQF-VIAXKJMFSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

DDJMOMHMVFXEQF-VIAXKJMFSA-N

UniChem compound ID

1 reference

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