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Atractylodin

Atractylodin structure

CAS No:
55290-63-6
Formula:
C13H10O
Chemical Name:
Atractylodin
Synonyms:
Furan,2-(1E,7E)-1,7-nonadiene-3,5-diyn-1-yl-;Atractylodin;Furan,2-(1,7-nonadiene-3,5-diynyl)-,(E,E)-;Furan,2-(1E,7E)-1,7-nonadiene-3,5-diynyl-;2-(1E,7E)-1,7-Nonadiene-3,5-diyn-1-ylfuran;Atractydin
Categories:
Biochemical Engineering > Chinese Herbs

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Description

Atractylodin is an active component of the essential oil contained in the rhizomes of Atractylodes lancea and A.

Atractylodin is a member of furans.

Atractylodin Basic Attributes

Molecular Weight：

182.22

Exact Mass：

182.22

HScode：

2932190090

Characteristics

PSA：

13.1

XLogP3：

6.38

Density：

1.1±0.1 g/cm3

Melting Point：

52 °C

Boiling Point：

305.5±34.0 °C at 760 mmHg

Flash Point：

142.6±12.5 °C

Refractive Index：

1.591

Drug Information

MeSH Entry Terms：

atractylodin

Computed Properties

Molecular Weight:182.22
XLogP3:3.5
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:182.073164938
Monoisotopic Mass:182.073164938
Topological Polar Surface Area:13.1
Heavy Atom Count:14
Complexity:348
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Atractylodin

Description
Basic Attributes
Characteristics
Drug Information
Computed Properties
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Atractylodin

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