MetaADEDB 2.0 @ LMMD
2-butenal
(MLUCVPSAIODCQM-NSCUHMNNSA-N)
Structure
SMILES
C/C=C/C=O
Type(s)
Experimental
Molecular Formula:
C4H6O
Molecular Weight:
70.090
Log P:
0.7614
Hydrogen Bond Acceptor:
1
Hydrogen Bond Donor:
0
TPSA:
17.07
CAS Number(s):
123-73-9; 4170-30-3; 15798-64-8
Synonym(s)
1.
2-butenal
2.
2-butenal, (E)-isomer
3.
Crotonal
4.
crotonaldehyde
External Link(s)
MeSHC012796
PubChem Compound447466
BindingDB50318489
ChEBI41607
CHEMBLCHEMBL1086445
DrugBankDB04381
IUPHAR/BPS Guide to PHARMACOLOGY6288
KEGGcpd:C19377
Therapeutic Target DatabaseD0L3FN
D09CSB
ZINC1686876
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Amyotrophic Lateral Sclerosis17319283CTD
2Neoplasms10626223CTD
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