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

Details

Stereochemistry ABSOLUTE
Molecular Formula C20H30O3
Molecular Weight 318.4504
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 11.ALPHA.-HYDROXY-17-METHYLTESTOSTERONE

SMILES

[H][C@@]12CC[C@](C)(O)[C@@]1(C)C[C@@H](O)[C@@]3([H])[C@@]2([H])CCC4=CC(=O)CC[C@]34C

InChI

InChIKey=UBIBSXMTVJAYTQ-QMNUTNMBSA-N
InChI=1S/C20H30O3/c1-18-8-6-13(21)10-12(18)4-5-14-15-7-9-20(3,23)19(15,2)11-16(22)17(14)18/h10,14-17,22-23H,4-9,11H2,1-3H3/t14-,15-,16+,17+,18-,19-,20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H30O3
Molecular Weight 318.4504
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:20:30 GMT 2023
Edited
by admin
on Sat Dec 16 10:20:30 GMT 2023
Record UNII
0W51MUL8AL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
11.ALPHA.-HYDROXY-17-METHYLTESTOSTERONE
Common Name English
11,17-DIHYDROXY-17-METHYLANDROST-4-ENE-3-ONE, (11-ALPHA,17-BETA)-
Systematic Name English
ANDROST-4-EN-3-ONE, 11,17-DIHYDROXY-17-METHYL-, (11.ALPHA.,17.BETA.)-
Systematic Name English
NSC-12433
Code English
11.ALPHA.,17.BETA.-DIHYDROXY-17-METHYLANDROST-4-EN-3-ONE
Common Name English
17.ALPHA.-METHYL-11.ALPHA.17-DIHYDROXY-4-ANDROSTEN-3-ONE
Systematic Name English
11.ALPHA.-HYDROXY-17.ALPHA.-METHYLTESTOSTERONE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID50939376
Created by admin on Sat Dec 16 10:20:30 GMT 2023 , Edited by admin on Sat Dec 16 10:20:30 GMT 2023
PRIMARY
ECHA (EC/EINECS)
217-306-7
Created by admin on Sat Dec 16 10:20:30 GMT 2023 , Edited by admin on Sat Dec 16 10:20:30 GMT 2023
PRIMARY
PUBCHEM
102164
Created by admin on Sat Dec 16 10:20:30 GMT 2023 , Edited by admin on Sat Dec 16 10:20:30 GMT 2023
PRIMARY
FDA UNII
0W51MUL8AL
Created by admin on Sat Dec 16 10:20:30 GMT 2023 , Edited by admin on Sat Dec 16 10:20:30 GMT 2023
PRIMARY
CAS
1807-02-9
Created by admin on Sat Dec 16 10:20:30 GMT 2023 , Edited by admin on Sat Dec 16 10:20:30 GMT 2023
PRIMARY
NSC
12433
Created by admin on Sat Dec 16 10:20:30 GMT 2023 , Edited by admin on Sat Dec 16 10:20:30 GMT 2023
PRIMARY