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Cimifugin

Cimifugin structure

CAS No:
37921-38-3
Formula:
C16H18O6
Chemical Name:
Cimifugin
Synonyms:
5H-Furo[3,2-g][1]benzopyran-5-one,2,3-dihydro-7-(hydroxymethyl)-2-(1-hydroxy-1-methylethyl)-4-methoxy-,(2S)-;5H-Furo[3,2-g][1]benzopyran-5-one,2,3-dihydro-7-(hydroxymethyl)-2-(1-hydroxy-1-methylethyl)-4-methoxy-,(S)-;(2S)-2,3-Dihydro-7-(hydroxymethyl)-2-(1-hydroxy-1-methylethyl)-4-methoxy-5H-furo[3,2-g][1]benzopyran-5-one;Cimifugin;Cimitin;2,3-Dihydro-7-hydroxymethyl-2-(1-hydroxy-1-methylethyl)-4-methoxy-5H-furo-[3,2-g]-[1]-benzopyran-5-one;(2S)-7-(Hydroxymethyl)-2-(2-hydroxypropan-2-yl)-4-methoxy-2,3-dihydrofuro[3,2-g]chromen-5-one
Categories:
Biochemical Engineering > Saccharides

Description

Cimifugin is a major components of Yu-ping-feng-san, a Chinese medical formula that is used clinically for allergic diseases and characterized by reducing allergy relapse.

Cimifugin is an oxacycle and an organic heterotricyclic compound.

Cimifugin Basic Attributes

Molecular Weight：

306.32

Exact Mass：

306.31

DSSTox ID：

DTXSID10331690

Characteristics

PSA：

89.13000

XLogP3：

1.21

Density：

1.4±0.1 g/cm3

Melting Point：

107～109℃

Boiling Point：

546.4±50.0 °C at 760 mmHg

Flash Point：

204.9±23.6 °C

Refractive Index：

1.599

Drug Information

MeSH Entry Terms：

cimifugin

Computed Properties

Molecular Weight:306.31
XLogP3:0.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:306.11033829
Monoisotopic Mass:306.11033829
Topological Polar Surface Area:85.2
Heavy Atom Count:22
Complexity:485
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Cimifugin

CAS No.: 37921-38-3

Content: 99.00%

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CAS No.: 37921-38-3

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Guide of Cimifugin

Description
Basic Attributes
Characteristics
Drug Information
Computed Properties
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Cimifugin

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