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Synonyms (5)
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Analogs (13)

ZINC12494524

12494524

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since	Heavy atoms	Benign functionality
May 16^th, 2008	26	No

Popular Name: Tetrahydrocortisone Tetrahydrocortisone

Find On: PubMed — Wikipedia — Google

CAS Number: 53-05-4

Other Names:

(1S,2S,5S,7S,10S,11S,14R,15S)-5,14-dihydroxy-14-(2-hydroxyacetyl)-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-17-one

(3a,5b)-3,17,21-trihydroxy-pregnane-11,20-dione; 3,17-Dihydroxy-17-hydroxyacetyl-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-11-one; 3a,17,21-Trihydroxy-5a-pregnane-11,20-dione; 3a,17,21-Trihydroxy-5b-pregnane-11,20-dione; 3alpha,17,21-Trihydrox

(3a,5b)-3,17,21-trihydroxy-pregnane-11,20-dione;3,17-Dihydroxy-17-hydroxyacetyl-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-11-one;3a,17,21-Trihydroxy-5a-pregnane-11,20-dione;3a,17,21-Trihydroxy-5b-pregnane-11,20-dione;3alpha,17,21-trihydroxy-5b

(3a,5b)-3,17,21-trihydroxy-pregnane-11,20-dione;3,17-Dihydroxy-17-hydroxyacetyl-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-11-one;3a,17,21-Trihydroxy-5a-pregnane-11,20-dione;3a,17,21-Trihydroxy-5b-pregnane-11,20-dione;3alpha,17,21-Trihydroxypre

SMILES:

Download: MOL2 SDF SMILES Flexibase

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.80	2.08	-11.33	3	5	0	95	364.482	2	↓ MOL2 SDF SMILES Flexibase

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Analogs ( Draw Identity 99% 90% 80% 70% )

Synonyms (5)
Vendors (0)
Annotations (8)
Representations (1)
Notes (0)
Targets (0)
Clustered (0)
Reactome (0)
Rings (0)
Analogs (13)