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

PropertiesImage
MNX_IDMNXM2593 Image of MNXM2593
referencechebi:27967
formulaC19H26O3
global charge0
mol weight302.414
InChIKeyWSCUHXPGYUMQEX-KCZNZURUSA-N
InChIInChI=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
SMILESC[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2[C@@H](O)C[C@]2(C)C(=O)CC[C@@H]12
MNX internals
InChI (mnx)InChI=1/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 Image of MNXM2593
SMILES (mnx)[CH3:1][C@:18]12[CH2:8][CH2:7][C:12](=[O:20])[CH:9]=[C:11]1[CH2:3][CH2:4][C@H:13]1[C@@H:14]3[CH2:5][CH2:6][C:16](=[O:22])[C@@:19]3([CH3:2])[CH2:10][C@H:15]([OH:21])[C@@H:17]12
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)11
in models (compartimentalized) 7
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:27967
chebi:27967
WSCUHXPGYUMQEX-KCZNZURUSA-N 		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
WSCUHXPGYUMQEX-KCZNZURUSA-N 		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
11 beta-Hydroxyandrostenedione
11-Hydroxy-4-androstene-3,17-dione
11-Hydroxyandrostenedione
11-Hydroxyandrostenedione, (11alpha)-isomer
11-Hydroxyandrostenedione, (11beta)-isomer
11-Hydroxyandrostenedione, (9beta,10alpha,11alpha)-isomer
11-Hydroxyandrostenedione, (9beta,10alpha,11beta)-isomer
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
11beta-hydroxyandrost-4-ene-3,17-dione
2-Phenyl-3-methylmorpholine
3-Methyl-2-phenylmorpholine
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
Defenmetrazin
Dexphenmetrazine
Fenmetrazin
Hydrochloride, phenmetrazine
Oxazimedrine
Phenmetraline
Phenmetrazine hydrochloride
Preludin
USAF ge-1

bigg.metabolite:C05284
biggM:C05284
WSCUHXPGYUMQEX-KCZNZURUSA-N 		11beta-Hydroxyandrost-4-ene-3,17-dione

vmhM:C05284
vmhmetabolite:C05284
WSCUHXPGYUMQEX-ZFKIUBEUSA-N 		11beta-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

kegg.compound:C05284
keggC:C05284
WSCUHXPGYUMQEX-KCZNZURUSA-N 		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
WSCUHXPGYUMQEX-KCZNZURUSA-N 		11beta-Hydroxyandrostenedione
11beta-OHA4
11beta-hydroxyandrost-4-ene-3,17-dione
O3
ST 19:3

SLM:000597869
slm:000597869
WSCUHXPGYUMQEX-KCZNZURUSA-N 		11beta-hydroxyandrost-4-ene-3,17-dione

metacyc.compound:CPD-23964
metacycM:CPD-23964
WSCUHXPGYUMQEX-KCZNZURUSA-N 		11beta-hydroxyandrostenedione
11OHA4
11beta-hydroxy-4-androstene-3,17-dione
11beta-hydroxyandrost-4-ene-3,17-dione

seed.compound:cpd03135
seedM:cpd03135
WSCUHXPGYUMQEX-KCZNZURUSA-N 		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
vmhM:M_C05284 		secondary/obsolete/fantasy identifier