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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H32O3
Molecular Weight 308.4563
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3.BETA.,6.ALPHA.,17.BETA.-TRIHYDROXY-5.ALPHA.-ANDROSTANE

SMILES

C[C@@]12CC[C@@]([H])(C[C@]2([H])[C@]([H])(C[C@@]3([H])[C@]4([H])CC[C@@]([H])([C@@]4(C)CC[C@@]31[H])O)O)O

InChI

InChIKey=OFAZPSYXUKIJIK-JGRZZSDMSA-N
InChI=1S/C19H32O3/c1-18-7-5-11(20)9-15(18)16(21)10-12-13-3-4-17(22)19(13,2)8-6-14(12)18/h11-17,20-22H,3-10H2,1-2H3/t11-,12-,13-,14-,15+,16-,17-,18+,19-/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H32O3
Molecular Weight 308.4563
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 06:48:07 UTC 2021
Edited
by admin
on Sat Jun 26 06:48:07 UTC 2021
Record UNII
9PW83L45JI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3.BETA.,6.ALPHA.,17.BETA.-TRIHYDROXY-5.ALPHA.-ANDROSTANE
Systematic Name English
ANDROSTANE-3,6,17-TRIOL, (3.BETA.,5.ALPHA.,6.ALPHA.,17.BETA.)-
Systematic Name English
17.BETA.-TRIHYDROXY-5.ALPHA.-ANDROSTANE
Common Name English
ANDROSTANE-3,6,17-TRIOL
Common Name English
5.ALPHA.-ANDROSTANE-3.BETA.,6.ALPHA.,17.BETA.-TRIOL
Systematic Name English
5-ALPHA-ANDROSTANE-3-BETA,7-ALPHA,16-BETA-TRIOL
Common Name English
Code System Code Type Description
PUBCHEM
170796
Created by admin on Sat Jun 26 06:48:07 UTC 2021 , Edited by admin on Sat Jun 26 06:48:07 UTC 2021
PRIMARY
CAS
49644-04-4
Created by admin on Sat Jun 26 06:48:07 UTC 2021 , Edited by admin on Sat Jun 26 06:48:07 UTC 2021
PRIMARY
FDA UNII
9PW83L45JI
Created by admin on Sat Jun 26 06:48:07 UTC 2021 , Edited by admin on Sat Jun 26 06:48:07 UTC 2021
PRIMARY
Related Record Type Details
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