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11beta-hydroxyandrost-4-ene-3,17-dione

Properties

Image

Occurences in reactions

MNX_ID

MNXM2593

	#reac
in my sandbox	0
in MNXref (generic)	9
in models (compartimentalized)	5

formula

C₁₉H₂₆O₃

charge

mass

302.40794

reference

InChIKey

WSCUHXPGYUMQEX-KCZNZURUSA-N

InChI

InChI=1S/C19H26O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h9,13-15,17,21H,3-8,10H2,1-2H3/t13-,14-,15-,17+,18-,19-/m0/s1

SMILES

C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CCC2=O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:27967 chebi:27967	11beta-hydroxyandrost-4-ene-3,17-dione 11beta-Hydroxy-4-androstene-3,17-dione 11beta-Hydroxyandrost-4-ene-3,17-dione 4-Androsten-11beta-ol-3,17-dione 4-androsten-11beta-ol-3,17-dione Androst-4-ene-3,17-dione-11beta-ol
hmdb:HMDB0006773	11b-Hydroxyandrost-4-ene-3,17-dione (1S,2R,10S,11S,15S,17S)-17-hydroxy-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-6-ene-5,14-dione 11b-Hydroxy-4-androstene-3,17-dione 11beta-Hydroxy-4-androstene-3,17-dione 11beta-Hydroxyandrost-4-ene-3,17-dione 11beta-hydroxy-4-androstene-3,17-dione 4-Androsten-11b-ol-3,17-dione 4-Androsten-11beta-ol-3,17-dione 4-androsten-11beta-ol-3,17-dione Androst-4-ene-3,17-dione-11b-ol Androst-4-ene-3,17-dione-11beta-ol
bigg.metabolite:C05284 biggM:C05284	11beta-Hydroxyandrost-4-ene-3,17-dione
kegg.compound:C05284 keggC:C05284	11beta-Hydroxyandrost-4-ene-3,17-dione 4-Androsten-11beta-ol-3,17-dione Androst-4-ene-3,17-dione-11beta-ol
lipidmaps:LMST02020066 lipidmapsM:LMST02020066	11beta-hydroxyandrost-4-ene-3,17-dione
seed.compound:cpd03135 seedM:cpd03135	4-Androsten-11beta-ol-3,17-dione 11beta-Hydroxyandrost-4-ene-3,17-dione Androst-4-ene-3,17-dione-11beta-ol
hmdb:HMDB06773 chebi:19132 chebi:736 biggM:M_C05284 keggC:M_C05284 seedM:M_cpd03135	secondary/obsolete/fantasy identifier