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(20S)-17,20-dihydroxypregn-4-en-3-one

Properties

Image

Occurences in reactions

MNX_ID

MNXM734964

	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	3

formula

C₂₁H₃₂O₃

charge

mass

332.23514

reference

chebi:16418

InChIKey

MASCESDECGBIBB-HNXXTFFGSA-N

InChI

InChI=1S/C21H32O3/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/h12-13,16-18,22,24H,4-11H2,1-3H3/t13-,16+,17-,18-,19-,20-,21-/m0/s1

SMILES

C[C@H](O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:16418 chebi:16418	(20S)-17,20-dihydroxypregn-4-en-3-one 17alpha,20alpha-Dihydroxypregn-4-en-3-one
lipidmaps:LMST02030183 lipidmapsM:LMST02030183	(20S)-17,20-dihydroxypregn-4-en-3-one (20S)-17,20-dihydroxypregn-4-en-3-one 17alpha,20alpha-Dihydroxypregn-4-en-3-one 17alpha,20alpha-dihydroxypregn-4-en-3-one O3 ST 21:2
metacyc.compound:17-ALPHA20-ALPHA-DIHYDROXYPREGN-4-EN-3- metacycM:17-ALPHA20-ALPHA-DIHYDROXYPREGN-4-EN-3-	(20S)-17,20-dihydroxypregn-4-en-3-one 17alpha,20alpha-dihydroxypregn-4-en-3-one
lipidmaps:LMST02030151 lipidmapsM:LMST02030151	17,20-dihydroxypregn-4-en-3-one 17,20-dihydroxypregn-4-en-3-one O3 ST 21:2
sabiork.compound:7369 sabiorkM:7369 kegg.compound:C04518 keggC:C04518	17alpha,20alpha-Dihydroxypregn-4-en-3-one
hmdb:HMDB0011653	17alpha,20alpha-Dihydroxypregn-4-en-3-one (1S,2R,10R,11S,14R,15S)-14-hydroxy-14-[(1S)-1-hydroxyethyl]-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-6-en-5-one (20S)-17,20-Dihydroxypregn-4-en-3-one 17 alpha, 20 alpha-OHP 17 alpha, 20 alpha-p 17,20 alpha-OHP 17,20a-Dihydroxy-4-pregnen-3-one 17,20a-Dihydroxy-pregn-4-en-3-one 17,20alpha-Dihydroxy-4-pregnen-3-one 17,20alpha-Dihydroxy-pregn-4-en-3-one 17,20alpha-dihydroxy-4-pregnen-3-one 17,20alpha-dihydroxy-pregn-4-en-3-one 17-a,20-a-Dihydroxypregn-4-en-3-one 17-alpha,20-alpha-Dihydroxypregn-4-en-3-one 17-alpha,20-alpha-dihydroxypregn-4-en-3-one 17a,20a-Dihydroxy-4-pregnen-3-one 17a,20a-Dihydroxypregn-4-en-3-one 17a,20a-Dihydroxypregn-4-ene-3-one 17a,20a-Dihydroxyprogesterone 17a-Hydroxy-20a-dihydroprogesterone 17alpha,20alpha-Dihydroxy-4-pregnen-3-one 17alpha,20alpha-Dihydroxypregn-4-ene-3-one 17alpha,20alpha-Dihydroxyprogesterone 17alpha,20alpha-dihydroxy-4-pregnen-3-one 17alpha,20alpha-dihydroxypregn-4-en-3-one 17alpha,20alpha-dihydroxypregn-4-ene-3-one 17alpha,20alpha-dihydroxyprogesterone 17alpha-Hydroxy-20alpha-dihydroprogesterone 17alpha-hydroxy-20alpha-dihydroprogesterone 20a-Dihydroxyprogesterone 20alpha-Dihydroxyprogesterone 20alpha-dihydroxyprogesterone 4-Pregnen-17a, 20a-diol-3-one 4-Pregnen-17alpha, 20alpha-diol-3-one Pregn-4-ene-17a,20a-diol-3-one Pregn-4-ene-17alpha,20alpha-diol-3-one
seed.compound:cpd02750 seedM:cpd02750	17alpha,20alpha-Dihydroxypregn-4-en-3-one (20S)-17,20-dihydroxypregn-4-en-3-one 17-alpha,20-alpha-dihydroxypregn-4-en-3-one 17alpha,20alpha-dihydroxypregn-4-en-3-one
CHEBI:36726 chebi:36726	17alpha,20alpha-dihydroxypregn-4-en-3-one 17,20-dihydroxypregn-4-en-3-one
hmdb:HMDB0003851 hmdb:HMDB03851 hmdb:HMDB11653 chebi:11337 chebi:19169 chebi:784 keggC:M_C04518 seedM:M_cpd02750	secondary/obsolete/fantasy identifier