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Altholactone

Altholactone structure

CAS No:
65408-91-5
Formula:
C13H12O4
Chemical Name:
Altholactone
Synonyms:
D-xylo-Hept-2-enonic acid,4,7-anhydro-2,3-dideoxy-7-C-phenyl-,δ-lactone,(7R)-;2H-Furo[3,2-b]pyran,D-xylo-hept-2-enonic acid deriv.;Altholactone;Goniothalenol;(+)-Altholactone;(+)-Goniothalenol
Categories:
Natural Products > Phenols

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Description

Goniothalenol is a furopyran.

Altholactone Basic Attributes

Molecular Weight：

232.23198

Exact Mass：

232.23

DSSTox ID：

DTXSID90331855

Characteristics

PSA：

55.8

XLogP3：

0.9

Density：

1.336±0.06 g/cm3(Predicted)

Melting Point：

108-109 °C @ Solvent: Ethanol, Benzene

Boiling Point：

490.4ºC at 760 mmHg

Flash Point：

196.1ºC

Refractive Index：

1.598

Storage Conditions：

-20°C

Safety Information

Transport codes：

UN 2811 6.1 / PGIII

wgk germany：

hazard class code：

safety instructions：

Marks：

Drug Information

MeSH Entry Terms：

2-phenyl-3-hydroxy-6,7-dihydro-furano-pyrone

Computed Properties

Molecular Weight:232.23
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:232.07355886
Monoisotopic Mass:232.07355886
Topological Polar Surface Area:55.8
Heavy Atom Count:17
Complexity:332
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes