(glutathion-S-yl)-bimane

Chemical Formula:

C₂₀H₂₆N₅O₈S

Molecular Weight:

496.514 Daltons

Monoisotopic Mass:

498.1658585916 Daltons

SMILES:

CC2(=C(N1(N(C(=O)C(C)=C(CSCC(C(NCC([O-])=O)=O)NC(=O)CCC([N+])C([O-])=O)1)C(=O)2))C)

InChI:

1S/C20H27N5O8S/c1-9-11(3)24-14(10(2)19(31)25(24)18(9)30)8-34-7-13(17(29)22-6-16(27)28)23-15(26)5-4-12(21)20(32)33/h12-13H,4-8,21H2,1-3H3,(H,22,29)(H,23,26)(H,27,28)(H,32,33)/p-1/t12-,13-/m0/s1

InChIKey:

KPJNKLWIESQKCG-STQMWFEESA-M

Synonyms

bimane-S-glutathione

Databases

MetaCyc: CPD-21160

PubChem (CID): 134820297