5-S-cysteinyldopaquinone

5-<i>S</i>-cysteinyldopaquinone




Chemical Formula:
C12H14N2O6S
Molecular Weight:
314.312 Daltons
Monoisotopic Mass:
316.0729069466 Daltons
SMILES:
C(C(C(=O)[O-])[N+])C1(=CC(C(C(=C1)SCC(C(=O)[O-])[N+])=O)=O)
InChI:
1S/C12H14N2O6S/c13-6(11(17)18)1-5-2-8(15)10(16)9(3-5)21-4-7(14)12(19)20/h2-3,6-7H,1,4,13-14H2,(H,17,18)(H,19,20)/t6-,7-/m0/s1
InChIKey:
HOKJXHGZPDVBLS-BQBZGAKWSA-N

Databases
MetaCyc:  CPD-20262
PubChem (CID):  131841577