Androstane-3,17-diol
PubChem CID
32801
Structure
Molecular Formula
Synonyms
- ANDROSTANE-3,17-DIOL
- Androstanediol
- 25126-76-5
- (3aS,3bR,9aS,9bS,11aS)-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthrene-1,7-diol
- (8R,9S,10S,13S,14S)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol
Molecular Weight
292.5 g/mol
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Dates
- Create:2005-08-08
- Modify:2025-01-11
Description
Androstane-3,17-diol is a 17-hydroxy steroid, a 3-hydroxy steroid and an androstanoid.
The unspecified form of the steroid, normally a major metabolite of TESTOSTERONE with androgenic activity. It has been implicated as a regulator of gonadotropin secretion.
Chemical Structure Depiction
(8R,9S,10S,13S,14S)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol
Computed by Lexichem TK 2.7.0 (PubChem release 2021.10.14)
InChI=1S/C19H32O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-17,20-21H,3-11H2,1-2H3/t12?,13?,14-,15-,16-,17?,18-,19-/m0/s1
Computed by InChI 1.0.6 (PubChem release 2021.10.14)
CBMYJHIOYJEBSB-CAHXEBCQSA-N
Computed by InChI 1.0.6 (PubChem release 2021.10.14)
C[C@]12CCC(CC1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CCC4O)C)O
Computed by OEChem 2.3.0 (PubChem release 2024.12.12)
C19H32O2
Computed by PubChem 2.2 (PubChem release 2021.10.14)
37293-02-0
- 5 alpha Androstane 3 alpha,17 beta diol
- 5 alpha Androstane 3 beta,17 alpha diol
- 5 alpha Androstane 3 beta,17 beta diol
- 5 alpha Androstane 3alpha,17 beta diol
- 5 alpha-Androstane-3 alpha,17 beta-diol
- 5 alpha-Androstane-3 beta,17 alpha-diol
- 5 alpha-Androstane-3 beta,17 beta-diol
- 5 alpha-Androstane-3alpha,17 beta-diol
- 5 Androstane 3,17 diol
- 5 beta Androstane 3 alpha,17 beta diol
- 5 beta-Androstane-3 alpha,17 beta-diol
- 5-Androstane-3,17-diol
- 5alpha Androstane 3beta,17alpha diol
- 5alpha-Androstane-3beta,17alpha-diol
- Androstane 3,17 diol
- Androstane-3,17-diol
- ANDROSTANE-3,17-DIOL
- Androstanediol
- 25126-76-5
- (3aS,3bR,9aS,9bS,11aS)-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthrene-1,7-diol
- (8R,9S,10S,13S,14S)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol
- 5 alpha Androstane 3 alpha,17 beta diol
- SCHEMBL3366554
- 5.xi.-Androstane-3,17-diol
- CHEBI:27727
- DTXSID00859494
- CBMYJHIOYJEBSB-CAHXEBCQSA-N
- 5beta-Androstan-3alpha,17alpha-diol
- 5.xi.-Androstane-3.xi.,17.xi.-diol
- DB-310117
- Q27103288
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
292.5 g/mol
Reference
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Property Name
XLogP3
Property Value
4.2
Reference
Computed by XLogP3 3.0 (PubChem release 2021.10.14)
Property Name
Hydrogen Bond Donor Count
Property Value
2
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Hydrogen Bond Acceptor Count
Property Value
2
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Rotatable Bond Count
Property Value
0
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Exact Mass
Property Value
292.240230259 Da
Reference
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Property Name
Monoisotopic Mass
Property Value
292.240230259 Da
Reference
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Property Name
Topological Polar Surface Area
Property Value
40.5 Ų
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Heavy Atom Count
Property Value
21
Reference
Computed by PubChem
Property Name
Formal Charge
Property Value
0
Reference
Computed by PubChem
Property Name
Complexity
Property Value
422
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Isotope Atom Count
Property Value
0
Reference
Computed by PubChem
Property Name
Defined Atom Stereocenter Count
Property Value
5
Reference
Computed by PubChem
Property Name
Undefined Atom Stereocenter Count
Property Value
3
Reference
Computed by PubChem
Property Name
Defined Bond Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Covalently-Bonded Unit Count
Property Value
1
Reference
Computed by PubChem
Property Name
Compound Is Canonicalized
Property Value
Yes
Reference
Computed by PubChem (release 2021.10.14)
NIST Number
42862
Library
Main library
Total Peaks
225
m/z Top Peak
41
m/z 2nd Highest
55
m/z 3rd Highest
67
Thumbnail
Follow these links to do a live 2D search or do a live 3D search for this compound, sorted by annotation score. This section is deprecated (see here for details), but these live search links provide equivalent functionality to the table that was previously shown here.
Same Connectivity Count
Same Isotope Count
Same Parent, Connectivity Count
Same Parent, Isotope Count
Mixtures, Components, and Neutralized Forms Count
Similar Compounds (2D)
Similar Conformers (3D)
PubMed Count
Anabolic Agents
These compounds stimulate anabolism and inhibit catabolism. They stimulate the development of muscle mass, strength, and power. (See all compounds classified as Anabolic Agents.)
Patents are available for this chemical structure:
https://patentscope.wipo.int/search/en/result.jsf?inchikey=CBMYJHIOYJEBSB-CAHXEBCQSA-N
- CAS Common ChemistryLICENSEThe data from CAS Common Chemistry is provided under a CC-BY-NC 4.0 license, unless otherwise stated.https://creativecommons.org/licenses/by-nc/4.0/Androstanediolhttps://commonchemistry.cas.org/detail?cas_rn=25126-76-5
- ChemIDplusAndrostane-3,17-diolhttps://pubchem.ncbi.nlm.nih.gov/substance/?source=chemidplus&sourceid=0025126765ChemIDplus Chemical Information Classificationhttps://pubchem.ncbi.nlm.nih.gov/source/ChemIDplus
- EPA DSSToxAndrostane-3,17-diolhttps://comptox.epa.gov/dashboard/DTXSID00859494CompTox Chemicals Dashboard Chemical Listshttps://comptox.epa.gov/dashboard/chemical-lists/
- ChEBIAndrostane-3,17-diolhttps://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:27727
- Japan Chemical Substance Dictionary (Nikkaji)
- KEGGLICENSEAcademic users may freely use the KEGG website. Non-academic use of KEGG generally requires a commercial licensehttps://www.kegg.jp/kegg/legal.html
- NIST Mass Spectrometry Data CenterLICENSEData covered by the Standard Reference Data Act of 1968 as amended.https://www.nist.gov/srd/public-lawAndrostane-3,17-diolhttp://www.nist.gov/srd/nist1a.cfm
- SpectraBaseAndrostane-3,17-diolhttps://spectrabase.com/spectrum/9y9l2ZzqpwGAndrostane-3,17-diolhttps://spectrabase.com/spectrum/2RmD0tczgw0
- Springer Nature
- Wikidataandrostane-3,17-diolhttps://www.wikidata.org/wiki/Q27103288
- Medical Subject Headings (MeSH)LICENSEWorks produced by the U.S. government are not subject to copyright protection in the United States. Any such works found on National Library of Medicine (NLM) Web sites may be freely used or reproduced without permission in the U.S.https://www.nlm.nih.gov/copyright.htmlAndrostane-3,17-diolhttps://www.ncbi.nlm.nih.gov/mesh/68015113Anabolic Agentshttps://www.ncbi.nlm.nih.gov/mesh/68045930
- PubChem
- PATENTSCOPE (WIPO)SID 403050668https://pubchem.ncbi.nlm.nih.gov/substance/403050668
- NCBI
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