MetaADEDB 2.0 @ LMMD
avobenzone
(XNEFYCZVKIDDMS-UHFFFAOYSA-N)
Structure
SMILES
COc1ccc(cc1)C(=O)CC(=O)c1ccc(cc1)C(C)(C)C
Type(s)
Approved; Investigational
Molecular Formula:
C20H22O3
Molecular Weight:
310.387
Log P:
4.4484
Hydrogen Bond Acceptor:
3
Hydrogen Bond Donor:
0
TPSA:
43.37
CAS Number(s):
70356-09-1; 87075-14-7
Synonym(s)
1.
avobenzone
2.
4-tert-butyl-4'-methoxydibenzoylmethane
3.
BMDBM cpd
4.
butyl-methoxydibenzoylmethane
5.
parsol 1789
6.
parsol-1789
External Link(s)
MeSHC049935
PubChem Compound51040
ChEBI134751
CHEMBLCHEMBL1200522
DrugBankDB09495
DrugCentral4242
KEGGdr:D03015
ZINC973
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Dermatitis, Photoallergic8957333CTD
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