MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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17alpha-hydroxyprogesterone

	Properties	Image
MNX_ID	MNXM730450
reference	chebi:17252
formula	C₂₁H₃₀O₃
global charge	0
mol weight	330.468
InChIKey	DBPWSSGDRRHUNT-CEGNMAFCSA-N
InChI	InChI=1S/C21H30O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h12,16-18,24H,4-11H2,1-3H3/t16-,17+,18+,19+,20+,21+/m1/s1
SMILES	CC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C

MNX internals

InChI (mnx)	InChI=1/C21H30O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h12,16-18,24H,4-11H2,1-3H3/t16-,17+,18+,19+,20+,21+/m1/s1
SMILES (mnx)	[CH3:1][C:13]([C@@:21]1([OH:24])[CH2:11][CH2:8][C@H:18]2[C@@H:16]3[CH2:5][CH2:4][C:14]4=[CH:12][C:15](=[O:23])[CH2:6][CH2:9][C@:19]4([CH3:2])[C@H:17]3[CH2:7][CH2:10][C@@:20]21[CH3:3])=[O:22]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	35
in models (compartimentalized)	20

Similar chemical compounds in external resources
Identifier	Description
reactome:R-ALL-193092 reactomeM:R-ALL-193092 CHEBI:17252 chebi:17252 DBPWSSGDRRHUNT-CEGNMAFCSA-N	17alpha-hydroxyprogesterone 17-Hydroxypregn-4-en-3,20-dione 17-hydroxypregn-4-ene-3,20-dione 17-hydroxyprogesterone 17alpha-Hydroxy-4-pregnene-3,20-dione 17alpha-Hydroxy-progesterone 17alpha-Hydroxyprogesterone Pregn-4-ene-3,20-dione-17-ol delta(4)-Pregnene-17alpha-ol-3,20-dione hidroxiprogesterona hydroxyprogesterone hydroxyprogesteronum
hmdb:HMDB0000374 DBPWSSGDRRHUNT-CEGNMAFCSA-N	17-Hydroxyprogesterone (1S,2R,10R,11S,14R,15S)-14-acetyl-14-hydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-6-en-5-one 17 Hydroxyprogesterone 17 alpha Hydroxyprogesterone 17 alpha-Hydroxyprogesterone 17-Hydroxypregn-4-en-3,20-dione 17-Hydroxypregn-4-ene-3,20-dione 17-Hydroxyprogesterone, (17 alpha)-isomer 17-Hydroxyprogesterone, (9 beta, 10 alpha)-isomer 17-OH Progesterone 17-OHP 17-alpha-Hydroxyprogesterone 17a-Hydroxy-4-pregnene-3,20-dione 17a-Hydroxy-progesterone 17a-Hydroxypregn-4-ene-3,20-dione 17a-Hydroxyprogesterone 17alpha-Hydroxy-4-pregnene-3,20-dione 17alpha-Hydroxy-progesterone 17alpha-Hydroxyprogesterone 17alpha-hydroxy-4-pregnene-3,20-dione 17alpha-hydroxy-progesterone D4-Pregnen-17a-ol-3,20-dione Gestageno Gestageno gador Hidroxiprogesterona Hydroxyprogesterone Hydroxyprogesteronum Pregn-4-en-17a-ol-3,20-dione Pregn-4-ene-3,20-dione-17-ol Prodix Prodox delta(4)-Pregnene-17a-ol-3,20-dione delta(4)-Pregnene-17alpha-ol-3,20-dione delta(4)-pregnene-17a-ol-3,20-dione delta(4)-pregnene-17alpha-ol-3,20-dione
metacyc.compound:17-ALPHA-HYDROXYPROGESTERONE metacycM:17-ALPHA-HYDROXYPROGESTERONE DBPWSSGDRRHUNT-CEGNMAFCSA-N	17-alpha-hydroxyprogesterone 17alpha-Hydroxy-4-pregnene-3,20-dione 17alpha-hydroxy-progesterone pregn-4-ene-3,20-dione-17-ol
bigg.metabolite:17ahprgstrn biggM:17ahprgstrn DBPWSSGDRRHUNT-CEGNMAFCSA-N	17alpha-Hydroxyprogesterone
seed.compound:cpd00866 seedM:cpd00866 DBPWSSGDRRHUNT-CEGNMAFCSA-N	17alpha-Hydroxyprogesterone 17-alpha-hydroxyprogesterone 17alpha-Hydroxy-4-pregnene-3,20-dione 17alpha-Hydroxy-progesterone 17alpha-hydroxy-progesterone Pregn-4-ene-3,20-dione-17-ol
sabiork.compound:5421 sabiorkM:5421 kegg.compound:C01176 keggC:C01176 DBPWSSGDRRHUNT-CEGNMAFCSA-N	17alpha-Hydroxyprogesterone 17alpha-Hydroxy-4-pregnene-3,20-dione 17alpha-Hydroxy-progesterone Pregn-4-ene-3,20-dione-17-ol
SLM:000485347 slm:000485347 DBPWSSGDRRHUNT-CEGNMAFCSA-N	17alpha-hydroxyprogesterone
vmhM:17ahprgstrn vmhmetabolite:17ahprgstrn DBPWSSGDRRHUNT-CEGNMAFCSA-N	17alpha-hydroxyprogesterone (1S,2R,10R,11S,14R,15S)-14-acetyl-14-hydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-6-en-5-one
lipidmaps:LMST02030161 lipidmapsM:LMST02030161 DBPWSSGDRRHUNT-CEGNMAFCSA-N	17alpha-hydroxyprogesterone 17-hydroxypregn-4-ene-3,20-dione 17-hydroxyprogesterone 17alpha-Hydroxy-4-pregnene-3,20-dione 17alpha-Hydroxy-progesterone 17alpha-Hydroxyprogesterone O3 Pregn-4-ene-3,20-dione-17-ol ST 21:3 hydroxyprogesterone
kegg.drug:D08052 keggD:D08052 DBPWSSGDRRHUNT-CEGNMAFCSA-N	Hydroxyprogesterone (INN)
envipath:...55e065aa04ea envipathM:...55e065aa04ea DBPWSSGDRRHUNT-CEGNMAFCSA-N	compound 0038852
hmdb:HMDB00374 chebi:11339 chebi:11340 chebi:19173 chebi:790 biggM:M_17ahprgstrn keggC:M_C01176 keggD:M_D08052 seedM:M_cpd00866 vmhM:M_17ahprgstrn	secondary/obsolete/fantasy identifier