(Q115965996)

English

(17-acetyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl) hydrogen sulfate

group of stereoisomers with the chemical formula C₂₁H₃₂O₅S

In more languages

Statements

group of stereoisomers

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chemical compound

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396.197045124 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₁H₃₂O₅S

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canonical SMILES

O=C(C)C1CCC2C3CC=C4CC(OS(=O)(=O)O)CCC4(C)C3CCC12C

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1 reference

A community-driven global reconstruction of human metabolism.

Identifiers

InChI=1S/C21H32O5S/c1-13(22)17-6-7-18-16-5-4-14-12-15(26-27(23,24)25)8-10-20(14,2)19(16)9-11-21(17,18)3/h4,15-19H,5-12H2,1-3H3,(H,23,24,25)

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DIJBBUIOWGGQOP-UHFFFAOYSA-N

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1 reference

3 January 2023

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

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