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Medicarpin

Medicarpin structure

CAS No:
32383-76-9
Formula:
C16H14O4
Chemical Name:
Medicarpin
Synonyms:
6H-Benzofuro[3,2-c][1]benzopyran-3-ol,6a,11a-dihydro-9-methoxy-,(6aR,11aR)-;6H-Benzofuro[3,2-c][1]benzopyran-3-ol,6a,11a-dihydro-9-methoxy-,cis-(-)-;6H-Benzofuro[3,2-c][1]benzopyran-3-ol,6a,11a-dihydro-9-methoxy-,(6aR-cis)-;(6aR,11aR)-6a,11a-Dihydro-9-methoxy-6H-benzofuro[3,2-c][1]benzopyran-3-ol;(-)-3-Hydroxy-9-methoxypterocarpan;(-)-Medicarpin;(-)-Demethylhomopterocarpin;Medicarpin,(-)-;l-3-Hydroxy-9-methoxypterocarpan;Medicarpin;3-Hydroxy-9-methoxypterocarpan;NSC 350085;Demethylhomopterocarpin;(6AR,11aR)-9-methoxy-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromen-3-ol;22973-30-4;36531-12-1
Categories:
Natural Products > Phenols

Description

(-)-medicarpin is the (-)-enantiomer of medicarpin. It has a role as a plant metabolite. It is an enantiomer of a (+)-medicarpin.

Medicarpin Basic Attributes

Molecular Weight：

270.28

Exact Mass：

270.28

UNII：

6TX086I6IG

NSC Number：

350085

Characteristics

PSA：

47.9

XLogP3：

2.72

Density：

1.3±0.1 g/cm3

Melting Point：

128 °C

Boiling Point：

418.8±45.0 °C at 760 mmHg

Flash Point：

207.1±28.7 °C

Refractive Index：

1.630

Specific rotation：

D22 -226° (chloroform)

Drug Information

MeSH Entry Terms：

6a,11a-dihydro-9-methoxy-6H-benzofuro(3,2-c)(1)benzopyran-3-ol

Medicarpin Use and Manufacturing

Use Classification：

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

Computed Properties

Molecular Weight:270.28
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:270.08920892
Monoisotopic Mass:270.08920892
Topological Polar Surface Area:47.9
Heavy Atom Count:20
Complexity:360
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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