linamarin
Chemical Formula:
C10H17NO6
Molecular Weight:
247.247 Daltons
Monoisotopic Mass:
247.10558728350003 Daltons
SMILES:
CC(C)(C#N)OC1(OC(CO)C(O)C(O)C(O)1)
InChI:
1S/C10H17NO6/c1-10(2,4-11)17-9-8(15)7(14)6(13)5(3-12)16-9/h5-9,12-15H,3H2,1-2H3/t5-,6-,7+,8-,9+/m1/s1
InChIKey:
Synonyms
- 2-(β-D-glucopyranosyloxy)-2-methylpropanenitrile
- 1-cyano-1-methylethyl beta-D-glucoside
Databases
MetaCyc:
LINAMARIN
RefMet:
Linamarin
HMDB:
HMDB33699
ChemSpider:
10657
ChEBI:
16441
PubChem (CID):
11128
KEGG:
C01594
CAS:
554-35-8
Seed:
cpd01121
MetaNetX:
MNXM4035