MetaADEDB 2.0 @ LMMD
primin
(WLWIMKWZMGJRBS-UHFFFAOYSA-N)
Structure
SMILES
CCCCCC1=CC(=O)C=C(C1=O)OC
Molecular Formula:
C12H16O3
Molecular Weight:
208.254
Log P:
2.1752
Hydrogen Bond Acceptor:
3
Hydrogen Bond Donor:
0
TPSA:
43.37
CAS Number(s):
15121-94-5
Synonym(s)
1.
primin
2.
2-methoxy-6-n-pentyl-p-benzoquinone
External Link(s)
MeSHC014773
PubChem Compound84800
ChEBI8413
CHEMBLCHEMBL451919
KEGGcpd:C10390
ZINC1531806
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Dermatitis, Allergic Contact11298694CTD
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