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16beta-Hydroxydisitoxigenin

16beta-Hydroxydisitoxigenin structure

CAS No:
131089-46-8
Formula:
C27H40N2O18
Chemical Name:
16beta-Hydroxydisitoxigenin
Synonyms:
16beta-Hydroxydigitoxigenin; 16beta-Hydroxydisitoxigenin;

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16beta-Hydroxydisitoxigenin Basic Attributes

Molecular Weight：

680.60900

Exact Mass：

680.22761243

DSSTox ID：

DTXSID20156891

Characteristics

PSA：

315.86000

XLogP3：

-3.97650

Density：

1.65g/cm3

Boiling Point：

1024.1ºC at 760mmHg

Flash Point：

573.1ºC

Refractive Index：

1.659

Vapor Pressure：

0mmHg at 25°C

Drug Information

MeSH Entry Terms：

4-NADGMG

Computed Properties

Molecular Weight:680.6
XLogP3:-4.7
Hydrogen Bond Donor Count:10
Hydrogen Bond Acceptor Count:18
Rotatable Bond Count:10
Exact Mass:680.22761243
Monoisotopic Mass:680.22761243
Topological Polar Surface Area:312
Heavy Atom Count:47
Complexity:1050
Defined Atom Stereocenter Count:15
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 16beta-Hydroxydisitoxigenin

Basic Attributes
Characteristics
Drug Information
Computed Properties

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