avenate A

Chemical Formula:

C₁₂H₂₁N₂O₈

Molecular Weight:

321.306 Daltons

Monoisotopic Mass:

324.1532657576 Daltons

SMILES:

C(O)C[CH](C([O-])=O)[N+]CCC(C([O-])=O)[N+]CCC(C([O-])=O)O

InChI:

1S/C12H22N2O8/c15-6-3-8(11(19)20)13-4-1-7(10(17)18)14-5-2-9(16)12(21)22/h7-9,13-16H,1-6H2,(H,17,18)(H,19,20)(H,21,22)/p-1/t7-,8-,9?/m0/s1

InChIKey:

QUKMQOBHQMWLLR-JVIMKECRSA-M

Synonyms

Databases

MetaCyc: CPD-19378

PubChem (CID): 122706269

MetaNetX: MNXM167143