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 11,17-DIHYDROXY-17-METHYLANDROST-4-ENE-3-ONE, (11-BETA,17-BETA)-

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-OWLVHUDESA-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 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 06:52:03 GMT 2023
Edited
by admin
on Sat Dec 16 06:52:03 GMT 2023
Record UNII
408KJY51K3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
11,17-DIHYDROXY-17-METHYLANDROST-4-ENE-3-ONE, (11-BETA,17-BETA)-
Common Name English
NSC-11677
Code English
ANDROST-4-ENE-3-ONE, 11,17-DIHYDROXY-17-METHYL-, (11-BETA,17-BETA)-
Common Name English
NSC-3359
Code English
U-5437
Code English
ANDROST-4-EN-3-ONE,11.BETA.,17.BETA.-DIHYDROXY-17-METHYL-
Common Name English
TESTOSTERONE, 11.BETA.-HYDROXY-17-METHYL-
Common Name English
17-ALPHA-METHYL-11-BETA,17-DIHYDROXY-4-ANDROSTEN-3-ONE
Common Name English
Code System Code Type Description
NSC
3359
Created by admin on Sat Dec 16 06:52:03 GMT 2023 , Edited by admin on Sat Dec 16 06:52:03 GMT 2023
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CAS
1043-10-3
Created by admin on Sat Dec 16 06:52:03 GMT 2023 , Edited by admin on Sat Dec 16 06:52:03 GMT 2023
PRIMARY
FDA UNII
408KJY51K3
Created by admin on Sat Dec 16 06:52:03 GMT 2023 , Edited by admin on Sat Dec 16 06:52:03 GMT 2023
PRIMARY
PUBCHEM
13970
Created by admin on Sat Dec 16 06:52:03 GMT 2023 , Edited by admin on Sat Dec 16 06:52:03 GMT 2023
PRIMARY
NSC
11677
Created by admin on Sat Dec 16 06:52:03 GMT 2023 , Edited by admin on Sat Dec 16 06:52:03 GMT 2023
PRIMARY
EPA CompTox
DTXSID60146377
Created by admin on Sat Dec 16 06:52:03 GMT 2023 , Edited by admin on Sat Dec 16 06:52:03 GMT 2023
PRIMARY
ECHA (EC/EINECS)
213-871-9
Created by admin on Sat Dec 16 06:52:03 GMT 2023 , Edited by admin on Sat Dec 16 06:52:03 GMT 2023
PRIMARY