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5-BETA-PREGNAN-3-ALPHA,11-ALPHA,17,20-ALPHA-TETROL

5-BETA-PREGNAN-3-ALPHA,11-ALPHA,17,20-ALPHA-TETROL structure

CAS No:
1242-48-4
Formula:
C21H36O4
Chemical Name:
5-BETA-PREGNAN-3-ALPHA,11-ALPHA,17,20-ALPHA-TETROL
Synonyms:
PREGNANETETROL;5beta-pregnane-3alpha,11beta,17,20alpha-tetrol;5BETA-PREGNAN-3ALPHA,11BETA,17ALPHA,20ALPHA-TETROL;3ALPHA,11B,17ALPHA,20ALPHA-Tetrahydroxy-5B-pregnane;5-BETA-PREGNAN-3-ALPHA,11-ALPHA,17,20-ALPHA-TETROL;(3R,5R,8S,9S,10S,11S,13S,14S,17R)-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,11,17-triol

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5-BETA-PREGNAN-3-ALPHA,11-ALPHA,17,20-ALPHA-TETROL Basic Attributes

Molecular Weight：

352.50800

Exact Mass：

352.26100

Characteristics

PSA：

80.92000

XLogP3：

2.47270

Density：

1.188g/cm3

Boiling Point：

508.7ºC at 760mmHg

Flash Point：

227.5ºC

Refractive Index：

1.569

Drug Information

MeSH Entry Terms：

5 beta-pregnane-3 alpha,11 beta,17,20 alpha-tetrol

Computed Properties

Molecular Weight:352.5
XLogP3:2.6
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:352.26135963
Monoisotopic Mass:352.26135963
Topological Polar Surface Area:80.9
Heavy Atom Count:25
Complexity:538
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-BETA-PREGNAN-3-ALPHA,11-ALPHA,17,20-ALPHA-TETROL

Basic Attributes
Characteristics
Drug Information
Computed Properties

5-BETA-PREGNAN-3-ALPHA,11-ALPHA,17,20-ALPHA-TETROL

SDS

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