5-ALPHA-ANDROST-16-EN-3-ONE

Structure

2D structure of 5-ALPHA-ANDROST-16-EN-3-ONE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 6852393

Names and identifiers

Name

5-ALPHA-ANDROST-16-EN-3-ONE

IUPAC name

(5S,8R,9S,10S,13R,14S)-10,13-dimethyl-1,2,4,5,6,7,8,9,10,11,12,13,14,15-tetradecahydro-3H-cyclopenta[a]phenanthren-3-one

SMILES

C[C@]12CC[C@H]3[C@H]([C@@H]1CC=C2)CC[C@@H]4[C@@]3(CCC(=O)C4)C

General information

Molecular formula

C19H28O

Molecular weight

272.43 g/mol

Monoisotopic mass

272.2140 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

Chemical classification: NPClassifier (Kim et al., 2021)

Plants with the compound

Plant Plant part Amount Reference
Pastinaca sativa L. subsp. sativa root -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.