O-sinapoylcholine
Chemical Formula:
C16H24NO5
Molecular Weight:
310.369 Daltons
Monoisotopic Mass:
310.1654478861 Daltons
SMILES:
C(COC(=O)C=CC1(C=C(OC)C(O)=C(C=1)OC))[N+](C)(C)C
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
InChIKey:
Synonyms
- sinapoylcholine
- sinapine
Databases
MetaCyc:
O-SINAPOYLCHOLINE
HMDB:
HMDB29379
CAS:
18696-26-9
ChEBI:
16353
PubChem (CID):
5280385
KEGG:
C00933
RefMet:
Sinapine
Seed:
cpd00690
MetaNetX:
MNXM2431