SpiceCom: A database of phytochemicals in major spices

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BETA-BISABOLOL

PubChem ID
27208
Chemical Name
BETA-BISABOLOL
Molecular Formula
C15H26O
Canonical SMILES
CC1=CCC(CC1)(C(C)CCC=C(C)C)O
IUPAC Name
4-methyl-1-(6-methylhept-5-en-2-yl)cyclohex-3-en-1-ol
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
Molecular Weight
222.372 g/mol
XLogP
4
Rotatable Bond Count
4
Lipinsky's Rule of Five
Yes
Sources
Black pepper, Ginger
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