MetaADEDB 2.0 @ LMMD
cinnamic aldehyde
(KJPRLNWUNMBNBZ-QPJJXVBHSA-N)
Structure
SMILES
O=C/C=C/c1ccccc1
Type(s)
Approved; Experimental
Molecular Formula:
C9H8O
Molecular Weight:
132.159
Log P:
1.8987
Hydrogen Bond Acceptor:
1
Hydrogen Bond Donor:
0
TPSA:
17.07
CAS Number(s):
104-55-2; 14371-10-9
Synonym(s)
1.
cinnamic aldehyde
2.
3-phenylprop-2-enaldehyde
3.
beta-phenylacrolein
4.
cinnamaldehyde
5.
cinnamic aldehyde, (E)-isomer
6.
supercinnamaldehyde
7.
trans-3-phenylprop-2-enaldehyde
External Link(s)
MeSHC012843
PubChem Compound637511
BindingDB50203065
ChEBI16731
142921
CHEMBLCHEMBL293492
DrugBankDB14184
IUPHAR/BPS Guide to PHARMACOLOGY2423
KEGGcpd:C00903
Therapeutic Target DatabaseD0PJ3M
ZINC1532777
Adverse Drug Event(s)
Powered by :

Page last updated at 2020-05-25 10:01:57 (Asia/Shanghai) | You are visitor No. 120239

Copyright © 2019-2020 Laboratory of Molecular Modeling and Design, Shanghai Key Laboratory of New Drug Design, School of Pharmacy, East China University of Science and Technology. All rights reserved.