Catalog Number
ANC00289
Product Name
Sinapine
Structure
Sinapine
CAS Number
18696-26-9
IUPAC Name
2-[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxyethyl-trimethylazanium
Synonyms
Sinapoylcholine; O-sinapoylcholine
Molecular Formula
C16H24NO5+
Molecular Weight
310.36
Appearance
Powder
Purity
98%
SMILES
C[N+](C)(C)CCOC(=O)/C=C/C1=CC(=C(C(=C1)OC)O)OC
InChI
InChI=1S/C16H23NO5/c1-17(2,3)8-9-22-15(18)7-6-12-10-13(20-4)16(19)14(11-12)21-5/h6-7,10-11H,8-9H2,1-5H3/p+1
InChI Key
HUJXHFRXWWGYQH-UHFFFAOYSA-O
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