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PROANTHOCYANIDIN-B1
PubChem ID
11250133
Chemical Name
PROANTHOCYANIDIN-B1
Molecular Formula
C
30
H
26
O
12
Canonical SMILES
C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O
IUPAC Name
(2R,3S)-2-(3,4-dihydroxyphenyl)-8-[(2R,3R,4R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol
Hydrogen Bond Donors
10
Hydrogen Bond Acceptors
12
Molecular Weight
578.526 g/mol
XLogP
2.4
Rotatable Bond Count
3
Lipinsky's Rule of Five
No
Sources
Cinnamon
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2D SDF
3D SDF
mol
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