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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H28O
Molecular Weight 272.425
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Androst-3-en-17-one, (5α)-

SMILES

[H][C@@]12CCC(=O)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])CC[C@@]4([H])C=CCC[C@]34C

InChI

InChIKey=RJWNCDOWHNLVPF-HKQXQEGQSA-N
InChI=1S/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3,5,13-16H,4,6-12H2,1-2H3/t13-,14+,15+,16+,18+,19+/m1/s1

HIDE SMILES / InChI

Molecular Formula C19H28O
Molecular Weight 272.425
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:44:00 GMT 2023
Edited
by admin
on Sat Dec 16 15:44:00 GMT 2023
Record UNII
QR7BMS5XDS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Androst-3-en-17-one, (5α)-
Common Name English
5α-Androst-3-en-17-one
Common Name English
(5s,8r,9s,10s,13s,14s)-10,13-dimethyl-1,2,5,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one
Systematic Name English
(5α)-Androst-3-en-17-one
Common Name English
(3aS,3bR,5aS,9aS,9bS,11aS)-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,5H,5aH,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-one
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID70473247
Created by admin on Sat Dec 16 15:44:00 GMT 2023 , Edited by admin on Sat Dec 16 15:44:00 GMT 2023
PRIMARY
PUBCHEM
11807837
Created by admin on Sat Dec 16 15:44:00 GMT 2023 , Edited by admin on Sat Dec 16 15:44:00 GMT 2023
PRIMARY
CAS
14935-81-0
Created by admin on Sat Dec 16 15:44:00 GMT 2023 , Edited by admin on Sat Dec 16 15:44:00 GMT 2023
PRIMARY
FDA UNII
QR7BMS5XDS
Created by admin on Sat Dec 16 15:44:00 GMT 2023 , Edited by admin on Sat Dec 16 15:44:00 GMT 2023
PRIMARY