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Homecas91893-83-3

91893-83-3

91893-83-3 structural image
Product Name: GARCINOLIC ACID; TRANS-(SH)
Formula: C27H38O4
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SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06

Environment
GHS09
GHS Hazard Statements H301:Acute toxicity,oral
H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P273:Avoid release to the environment.

COMPUTED DESCRIPTORS

Molecular Weight 426.6 g/mol
XLogP3 7.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 10
Exact Mass 426.27700969 g/mol
Monoisotopic Mass 426.27700969 g/mol
Topological Polar Surface Area 66.8 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 689
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 3
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

CID 133556427 is a natural product found in Garcinia kola with data available.