Androstenedione

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Systematic / IUPAC Name: Androst-4-ene-3,17-dione

ID: Reference230

Other Names: Androstenedione;
Androst-4-ene-3,17-dione;
4-Androstenedione;
3,17-Dioxoandrost-4-ene;
17-Ketotestosterone ; more

Formula: C19H26O2

Class: Endogenous Metabolites

Spectral Data

Androstenedione mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 1
No. of Spectra 138
Tandem Spectra MS1, MS2, MS3
Ionization Methods ESI
Analyzers FT
Last Modification 11/26/2014 1:36:54 PM
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Identificators

InChI InChI=1S/C19H26O2/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/h11,14-16H,3-10H2,1-2H3/t14-,15-,16-,18-,19-/m0/s1
InChI Key AEMFNILZOJDQLW-QAGGRKNESA-N
Canonical SMILES O=C4/C=C3/CCC2C(CCC1(C(=O)CCC12)C)C3(C)CC4
CAS 63058
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Other Names Androstenedione;
Androst-4-ene-3,17-dione;
4-Androstenedione;
3,17-Dioxoandrost-4-ene;
17-Ketotestosterone;
4-Androstene-3-17-dione;
Androsten-3,17-dione;
4-Androsten-3,17-dione;
Fecundin;
Androtex;
ASD

In Other Databases

ChEMBL CHEMBL274826
HMDb HMDB00053
Wikipedia Androstenedione
ChemSpider 2108; 21230427
PubChem 6128
ChEBI CHEBI:16422
KEGG C00280; D00051
ChemIDPlus 000063058