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(6aS,11aS)-9-Methoxy-10-(3-methyl-2-buten-1-yl)-6H-benzofuro[3,2-c][1]benzopyran-3,6a(11aH)-diol

(6aS,11aS)-9-Methoxy-10-(3-methyl-2-buten-1-yl)-6H-benzofuro[3,2-c][1]benzopyran-3,6a(11aH)-diol structure

CAS No:
74515-47-2
Formula:
C21H22O5
Chemical Name:
(6aS,11aS)-9-Methoxy-10-(3-methyl-2-buten-1-yl)-6H-benzofuro[3,2-c][1]benzopyran-3,6a(11aH)-diol
Synonyms:
6H-Benzofuro[3,2-c][1]benzopyran-3,6a(11aH)-diol,9-methoxy-10-(3-methyl-2-buten-1-yl)-,(6aS,11aS)-;6H-Benzofuro[3,2-c][1]benzopyran-3,6a(11aH)-diol,9-methoxy-10-(3-methyl-2-butenyl)-,(6aS-cis)-;6H-Benzofuro[3,2-c][1]benzopyran-3,6a(11aH)-diol,9-methoxy-10-(3-methyl-2-butenyl)-,(6aS,11aS)-;(6aS,11aS)-9-Methoxy-10-(3-methyl-2-buten-1-yl)-6H-benzofuro[3,2-c][1]benzopyran-3,6a(11aH)-diol;Cristacarpin;Erythrabyssin I;Erythrabissin I;6α-Hydroxyphaseollidin
Categories:
Natural Products > Phenols

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Description

Cristacarpin is a member of pterocarpans.

(6aS,11aS)-9-Methoxy-10-(3-methyl-2-buten-1-yl)-6H-benzofuro[3,2-c][1]benzopyran-3,6a(11aH)-diol Basic Attributes

Molecular Weight：

354.39638

Exact Mass：

354.40

Characteristics

PSA：

68.2

XLogP3：

3.74

Density：

1.3±0.1 g/cm3

Boiling Point：

518.1±50.0 °C at 760 mmHg

Flash Point：

267.1±30.1 °C

Refractive Index：

1.636

Drug Information

MeSH Entry Terms：

cristacarpin

(6aS,11aS)-9-Methoxy-10-(3-methyl-2-buten-1-yl)-6H-benzofuro[3,2-c][1]benzopyran-3,6a(11aH)-diol Use and Manufacturing

Use Classification：

Polyketides [PK] -> Flavonoids [PK12] -> Pterocarpans [PK1207]

Computed Properties

Molecular Weight:354.4
XLogP3:3.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:354.14672380
Monoisotopic Mass:354.14672380
Topological Polar Surface Area:68.2
Heavy Atom Count:26
Complexity:545
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (6aS,11aS)-9-Methoxy-10-(3-methyl-2-buten-1-yl)-6H-benzofuro[3,2-c][1]benzopyran-3,6a(11aH)-diol

Description
Basic Attributes
Characteristics
Drug Information
Use and Manufacturing
Computed Properties
Latest News
Learn More Other Chemicals

(6aS,11aS)-9-Methoxy-10-(3-methyl-2-buten-1-yl)-6H-benzofuro[3,2-c][1]benzopyran-3,6a(11aH)-diol

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