Fe3+-[diglucosyl-(2,3-dihydroxybenzoylserine)2] complex

Fe<sup>3+</sup>-[diglucosyl-(2,3-dihydroxybenzoylserine)<sub>2</sub>] complex




Chemical Formula:
C32H35N2O21FE
Molecular Weight:
839.476 Daltons
Monoisotopic Mass:
840.1159983301 Daltons
SMILES:
C(O)C7(OC(C2(C=C1(O[Fe-]45(OC1=C(C=2)C(=O)NC(CO)C(OCC(NC(=O)C6(=CC(C3(OC(CO)C(O)C(O)C(O)3))=CC(O4)=C(O5)6))C([O-])=O)=O))))C(O)C(O)C(O)7)
InChI:
1S/C32H40N2O21.Fe/c35-5-13(33-29(48)11-1-9(3-15(38)19(11)40)27-25(46)23(44)21(42)17(6-36)54-27)32(52)53-8-14(31(50)51)34-30(49)12-2-10(4-16(39)20(12)41)28-26(47)24(45)22(43)18(7-37)55-28;/h1-4,13-14,17-18,21-28,35-47H,5-8H2,(H,33,48)(H,34,49)(H,50,51);/q;+3/p-5/t13-,14+,17+,18+,21+,22+,23-,24-,25+,26+,27-,28-;/m0./s1
InChIKey:
GCFJENJKAKJHRU-JTKYYMFJSA-I

Databases
MetaCyc:  CPD-21585
PubChem (CID):  135397969