homoisoalliin
Chemical Formula:
C7H13NO3S
Molecular Weight:
191.245 Daltons
Monoisotopic Mass:
192.06943901090003 Daltons
SMILES:
CCC=CS(=O)CC([N+])C(=O)[O-]
InChI:
1S/C7H13NO3S/c1-2-3-4-12(11)5-6(8)7(9)10/h3-4,6H,2,5,8H2,1H3,(H,9,10)/b4-3+/t6-,12?/m0/s1
InChIKey:
Synonyms
- (E)-S-(1-butenyl) cysteine S-oxide
Databases
MetaCyc:
CPD-13604
PubChem (CID):
91819826
MetaNetX:
MNXM18532