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tetrahydrocortisol

MNXM735654 is deprecated and replaced by MNXM735651

Properties

Image

Occurences in reactions

MNX_ID

MNXM735651

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

formula

C₂₁H₃₄O₅

charge

mass

366.24062

reference

chebi:28320

InChIKey

AODPIQQILQLWGS-GXBDJPPSSA-N

InChI

InChI=1S/C21H34O5/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/h12-16,18,22-24,26H,3-11H2,1-2H3/t12-,13-,14+,15+,16+,18-,19+,20+,21+/m1/s1

SMILES

C[C@]12CC[C@@H](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:28320 chebi:28320	tetrahydrocortisol 3alpha,11beta,17,21-tetrahydroxy-5beta-pregnan-20-one 3alpha,5beta-Tetrahydrocortisol 5beta-Pregnane-3alpha,11beta,17alpha,21-tetrol-20-one 5beta-Tetrahydrocortisol Tetrahydrocortisol Tetrahydrohydrocortisone Urocortisol
lipidmaps:LMST02030143 lipidmapsM:LMST02030143	Tetrahydrocortisol 3alpha,11beta,17,21-tetrahydroxy-5beta-pregnan-20-one 5b-Tetrahydrocortisol O5 ST 21:1 Urocortisol
sabiork.compound:7942 sabiorkM:7942	Urocortisol 5beta-Pregnane-3alpha,11beta,17alpha,21-tetrol-20-one
kegg.compound:C05472 keggC:C05472	Urocortisol 5beta-Pregnane-3alpha,11beta,17alpha,21-tetrol-20-one Tetrahydrocortisol
seed.compound:cpd03253 seedM:cpd03253	Urocortisol 5beta-Pregnane-3alpha,11beta,17alpha,21-tetrol-20-one Tetrahydrocortisol urocortisol
chebi:27249 chebi:9900 keggC:M_C05472 seedM:M_cpd03253	secondary/obsolete/fantasy identifier