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PROANTHOCYANIDIN
PubChem ID
108065
Chemical Name
PROANTHOCYANIDIN
Molecular Formula
C
31
H
28
O
12
Canonical SMILES
COC1=C(C=C(C=C1O)C2C(CC3=C(O2)C(=C(C=C3O)O)C4C(C(OC5=CC(=CC(=C45)O)O)C6=CC=C(C=C6)O)O)O)O
IUPAC Name
(3R)-2-(3,5-dihydroxy-4-methoxyphenyl)-8-[(2R,3R,4R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol
Hydrogen Bond Donors
9
Hydrogen Bond Acceptors
12
Molecular Weight
592.553 g/mol
XLogP
2.7
Rotatable Bond Count
4
Lipinsky's Rule of Five
No
Sources
Cinnamon
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2D SDF
3D SDF
mol
JPEG