U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry EPIMERIC
Molecular Formula C20H30O2
Molecular Weight 302.451
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (17?)-17-Methylandrosta-1,4-diene-3,17-diol

SMILES

C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(O)C=C[C@]4(C)[C@H]3CC[C@]12C

InChI

InChIKey=GDBGSQAQAIKYSV-IWPZMOPJSA-N
InChI=1S/C20H30O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h6,9,12,14-17,21-22H,4-5,7-8,10-11H2,1-3H3/t14?,15-,16+,17+,18+,19+,20+/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H30O2
Molecular Weight 302.451
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 6 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 20:03:27 GMT 2025
Edited
by admin
on Wed Apr 02 20:03:27 GMT 2025
Record UNII
YHY6UT58EX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(17?)-17-Methylandrosta-1,4-diene-3,17-diol
Systematic Name English
Androsta-1,4-diene-3,17-diol, 17-methyl-, (17?)-
Preferred Name English
Classification Tree Code System Code
DEA NO. 4000
Created by admin on Wed Apr 02 20:03:27 GMT 2025 , Edited by admin on Wed Apr 02 20:03:27 GMT 2025
Code System Code Type Description
CAS
1978330-60-7
Created by admin on Wed Apr 02 20:03:27 GMT 2025 , Edited by admin on Wed Apr 02 20:03:27 GMT 2025
PRIMARY
FDA UNII
YHY6UT58EX
Created by admin on Wed Apr 02 20:03:27 GMT 2025 , Edited by admin on Wed Apr 02 20:03:27 GMT 2025
PRIMARY