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14－Deoxy-11-oxoandrographolide

14－Deoxy-11-oxoandrographolide structure

CAS No:
42895-57-8
Formula:
C20H28O5
Chemical Name:
14－Deoxy-11-oxoandrographolide
Synonyms:
14－Deoxy-11-oxoandrographolide;(1R,4aβ)-Decahydro-1α-[2-(2,5-dihydro-2-oxofuran-4-yl)-1-oxoethyl]-6α-hydroxy-5α-hydroxymethyl-5,8aα-dimethyl-2-methylenenaphthalene

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14－Deoxy-11-oxoandrographolide Basic Attributes

Molecular Weight：

348.43332

Exact Mass：

348.194

Characteristics

PSA：

83.8

XLogP3：

1.7

Density：

1.21±0.1 g/cm3(Predicted)

Melting Point：

101 °C

Computed Properties

Molecular Weight:348.4
XLogP3:2.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:348.19367399
Monoisotopic Mass:348.19367399
Topological Polar Surface Area:83.8
Heavy Atom Count:25
Complexity:636
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 14－Deoxy-11-oxoandrographolide

Basic Attributes
Characteristics
Computed Properties

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