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19-oxotestosterone

Properties

Image

Occurences in reactions

MNX_ID

MNXM3143

	#reac
in my sandbox	0
in MNXref (generic)	15
in models (compartimentalized)	1

formula

C₁₉H₂₆O₃

charge

mass

302.18819

reference

InChIKey

TXNCGXATKOMEQC-KOUJMVCDSA-N

InChI

InChI=1S/C19H26O3/c1-18-8-7-16-14(15(18)4-5-17(18)22)3-2-12-10-13(21)6-9-19(12,16)11-20/h10-11,14-17,22H,2-9H2,1H3/t14-,15-,16-,17-,18-,19+/m0/s1

SMILES

C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C=O)[C@@H]1CC[C@@H]2O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:75308 chebi:75308	19-oxotestosterone (17beta)-17-hydroxy-3-oxoandrost-4-en-19-al
kegg.compound:C05295 keggC:C05295	19-Oxotestosterone
hmdb:HMDB0003959	19-Oxotestosterone (1S,2S,10S,11S,14S,15S)-14-hydroxy-15-methyl-5-oxotetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-6-ene-2-carbaldehyde 19-oxotestosterone
seed.compound:cpd12693 seedM:cpd12693	19-Oxotestosterone 19-aldehyde-testosterone 19-oxo-testosterone
metacyc.compound:19-OXO-TESTOSTERONE metacycM:19-OXO-TESTOSTERONE	19-oxo-testosterone 19-aldehyde-testosterone
hmdb:HMDB03959 chebi:800 keggC:M_C05295 seedM:M_cpd12693	secondary/obsolete/fantasy identifier