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5beta-dihydrocortisol

Properties

Image

Occurences in reactions

MNX_ID

MNXM735117

	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	1

formula

C₂₁H₃₂O₅

charge

mass

364.22497

reference

chebi:732

InChIKey

ACSFOIGNUQUIGE-AIPUTVCKSA-N

InChI

InChI=1S/C21H32O5/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/h12,14-16,18,22,24,26H,3-11H2,1-2H3/t12-,14+,15+,16+,18-,19+,20+,21+/m1/s1

SMILES

C[C@]12CCC(=O)C[C@H]1CC[C@@H]1[C@@H]2[C@@H](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:732 chebi:732	5beta-dihydrocortisol (5beta,11beta)-11,17,21-trihydroxypregnane-3,20-dione 11-beta,17,21-trihydroxy-5-beta-pregnane-3,20-dione 11beta,17alpha,21-trihydroxy-5beta-pregnane-3,20-dione dihydrocortisol
sabiork.compound:7941 sabiorkM:7941 kegg.compound:C05471 keggC:C05471	11beta,17alpha,21-Trihydroxy-5beta-pregnane-3,20-dione 5beta-Pregnane-11beta,17alpha,21-triol-3,20-dione
seed.compound:cpd03252 seedM:cpd03252	5beta-Pregnane-11beta,17alpha,21-triol-3,20-dione 11beta,17alpha,21-Trihydroxy-5beta-pregnane-3,20-dione
SLM:000485678 slm:000485678	5beta-dihydrocortisol
hmdb:HMDB0003259	Dihydrocortisol (1S,2S,7R,10S,11S,14R,15S,17S)-14,17-dihydroxy-14-(2-hydroxyacetyl)-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-5-one (5b,11b)-11,17,21-Trihydroxypregnane-3,20-dione (5beta,11beta)-11,17,21-Trihydroxypregnane-3,20-dione 11-b,17,21-Trihydroxy-5-b-pregnane-3,20-dione 11-beta,17,21-Trihydroxy-5-beta-pregnane-3,20-dione 11beta,17,21-Trihydroxy-5beta-pregnane-3,20-dione 11beta,17alpha,21-Trihydroxy-5beta-pregnane-3,20-dione 5-beta-Dihydrocortisol 5b-Pregnane-11b,17a,21-triol-3,20-dione 5beta-Dihydrocortisol 5beta-Pregnane-11beta,17alpha,21-triol-3,20-dione
lipidmaps:LMST02030204 lipidmapsM:LMST02030204	Dihydrocortisol O5 ST 21:2
hmdb:HMDB0012460 hmdb:HMDB03259 hmdb:HMDB12460 keggC:M_C05471 seedM:M_cpd03252	secondary/obsolete/fantasy identifier