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Caulophyllogenin

Caulophyllogenin structure

CAS No:
52936-64-8
Formula:
C30H48O5
Chemical Name:
Caulophyllogenin
Synonyms:
Olean-12-en-28-oic acid,3,16,23-trihydroxy-,(3β,4α,16α)-;(3β,4α,16α)-3,16,23-Trihydroxyolean-12-en-28-oic acid;Caulophyllogenin;Collinsogenin
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Caulophyllogenin Basic Attributes

Molecular Weight：

488.7

Exact Mass：

488.70

EC Number：

258-265-5

Characteristics

PSA：

XLogP3：

5.17680

Density：

1.19g/cm3

Melting Point：

>300°C(dec.)

Boiling Point：

621.5ºC at 760mmHg

Flash Point：

343.7ºC

Refractive Index：

1.58

Drug Information

MeSH Entry Terms：

(3beta,16alpha)-3,16,23-trihydroxyolean-12-en-28-oic acid

Computed Properties

Molecular Weight:488.7
XLogP3:6.2
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:488.35017463
Monoisotopic Mass:488.35017463
Topological Polar Surface Area:98
Heavy Atom Count:35
Complexity:941
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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