(glutathion-S-yl)-4-methoxy-3-indolylmethylisothiocyanate
Chemical Formula:
C21H26N5O7S2
Molecular Weight:
524.586 Daltons
Monoisotopic Mass:
526.1430146595 Daltons
SMILES:
COC2(=C1(C(NC=C(CNC(SCC(C(NCC([O-])=O)=O)NC(=O)CCC([N+])C([O-])=O)=S)1)=CC=C2))
InChI:
1S/C21H27N5O7S2/c1-33-15-4-2-3-13-18(15)11(7-23-13)8-25-21(34)35-10-14(19(30)24-9-17(28)29)26-16(27)6-5-12(22)20(31)32/h2-4,7,12,14,23H,5-6,8-10,22H2,1H3,(H,24,30)(H,25,34)(H,26,27)(H,28,29)(H,31,32)/p-1/t12-,14-/m0/s1
InChIKey:
Databases
MetaCyc:
CPDQT-435
Seed:
cpd26655
MetaNetX:
MNXM10212