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4,5beta-dihydrocortisone

MNXM732971 is deprecated and here replaced by MNXM1108060
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM1108060

	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	1

formula

C₂₁H₃₀O₅

charge

mass

362.20932

reference

chebi:18093

InChIKey

YCLWEYIBFOLMEM-FNLRALKVSA-N

InChI

InChI=1S/C21H30O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12,14-15,18,22,26H,3-11H2,1-2H3/t12-,14+,15+,18-,19+,20+,21+/m1/s1

SMILES

C[C@]12CCC(=O)C[C@H]1CC[C@@H]1[C@@H]2C(=O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:18093 chebi:18093	4,5beta-dihydrocortisone 17,21-dihydroxy-5beta-pregnane-3,11,20-trione 17alpha,21-Dihydroxy-5beta-pregnane-3,11,20-trione 4,5beta-Dihydrocortisone 5-dihydrocortisone 5beta-Pregnane-17alpha,21-diol-3,11,20-trione
SLM:000485356 slm:000485356	17,21-dihydroxy-5beta-pregnane-3,11,20-trione
hmdb:HMDB0006758	17a,21-Dihydroxy-5b-pregnane-3,11,20-trione (1S,2S,7R,10S,11S,14R,15S)-14-hydroxy-14-(2-hydroxyacetyl)-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecane-5,17-dione 17,21-Dihydroxy-5-beta-pregnane-3,11,20-trione 17,21-Dihydroxy-5b-pregnane-3,11,20-trione 17alpha,21-Dihydroxy-5beta-pregnane-3,11,20-trione 17alpha,21-dihydroxy-5beta-pregnane-3,11,20-trione 4,5-b-Dihydrocortisone 4,5-beta-Dihydrocortisone 4,5b-Dihydrocortisone 4,5beta-Dihydrocortisone 4,5beta-dihydrocortisone 5 beta-Dihydrocortisone 5 beta-Pregnan-17 alpha,21-dihydroxy-3,11,20-trione 5-Dihydrocortisone 5b-Pregnane-17a,21-diol-3,11,20-trione 5beta-Pregnane-17alpha,21-diol-3,11,20-trione 5beta-pregnane-17alpha,21-diol-3,11,20-trione dihydrocortisone
sabiork.compound:7939 sabiorkM:7939 kegg.compound:C05469 keggC:C05469	17alpha,21-Dihydroxy-5beta-pregnane-3,11,20-trione 4,5beta-Dihydrocortisone 5beta-Pregnane-17alpha,21-diol-3,11,20-trione
CHEBI:23736 chebi:23736	4,5-dihydrocortisone dihydrocortisone
lipidmaps:LMST02030095 lipidmapsM:LMST02030095	4,5beta-Dihydrocortisone 17,21-dihydroxy-5beta-pregnane-3,11,20-trione 17alpha,21-Dihydroxy-5beta-pregnane-3,11,20-trione 4,5beta-Dihydrocortisone 4,5beta-dihydrocortisone 5-dihydrocortisone 5beta-Pregnane-17alpha,21-diol-3,11,20-trione O5 ST 21:3
seed.compound:cpd03250 seedM:cpd03250	4,5beta-Dihydrocortisone 17,21-dihydroxy-5beta-pregnane-3,11,20-trione 17alpha,21-Dihydroxy-5beta-pregnane-3,11,20-trione 4,5beta-dihydrocortisone 5beta-Pregnane-17alpha,21-diol-3,11,20-trione
metacyc.compound:CPD-287 metacycM:CPD-287	4,5beta-dihydrocortisone 17,21-dihydroxy-5beta-pregnane-3,11,20-trione
sabiork.compound:26848 sabiorkM:26848	Dihydrocortisone
hmdb:HMDB06758 chebi:11927 chebi:1753 chebi:20277 chebi:785 keggC:M_C05469 seedM:M_cpd03250	secondary/obsolete/fantasy identifier