Structure

Frangulin a

CAS
521-62-0
Catalog Number
ACM521620
Category
Other Products
Molecular Weight
416.38
Molecular Formula
C21H20O9

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Specification

Synonyms
CASCARIN;EMODIN-6-(L)-O-RHAMNOSIDE;EMODIN-6-O-RHAMNOSIDE;EMODIN-L-RHAMNOSIDE;FRANGULIN;FRANGULIN A;RAHMNOXANTHIN;3-((6-deoxy-alpha-l-mannopyranosyl)oxy)-1,8-dihydroxy-6-methyl-9,10-anthrace
IUPAC Name
1,8-dihydroxy-3-methyl-6-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyanthracene-9,10-dione
Canonical SMILES
CC1C(C(C(C(O1)OC2=CC(=C3C(=C2)C(=O)C4=CC(=CC(=C4C3=O)O)C)O)O)O)O
InChI Key
DTTVUKLWJFJOHO-FUCRAMRQSA-N
Boiling Point
744.3ºC at 760 mmHg
Melting Point
230ºC
Flash Point
265.9ºC
Density
1.597 g/cm³
Appearance
white powder
EC Number
208-316-2
Exact Mass
416.11100
H-Bond Acceptor
9
H-Bond Donor
5
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