Fe3+-[salmochelin SX] complex

Fe<sup>3+</sup>-[salmochelin SX] complex




Chemical Formula:
C16H18NO11FE
Molecular Weight:
456.165 Daltons
Monoisotopic Mass:
457.03075255820005 Daltons
SMILES:
C(O)C3(OC(C2(=CC1(O[Fe+]OC=1C(=C2)C(=O)NC(CO)C([O-])=O)))C(O)C(O)C(O)3)
InChI:
1S/C16H21NO11.Fe/c18-3-7(16(26)27)17-15(25)6-1-5(2-8(20)10(6)21)14-13(24)12(23)11(22)9(4-19)28-14;/h1-2,7,9,11-14,18-24H,3-4H2,(H,17,25)(H,26,27);/q;+3/p-3/t7-,9+,11+,12-,13+,14-;/m0./s1
InChIKey:
XQDCQPPMOATTGF-CSCLAODDSA-K

Synonyms
  • ferric-parcifarinic acid
  • ferric-parcifarinate

Databases
MetaCyc:  CPD-21608
ChEBI:  143777
PubChem (CID):  135398086