Chemical Compound

DTXSID40975728

CAS Registry Number 60318-31-2
DTXSID40975728 chemical structure
Primary Record

DTXSID40975728

In stock
3,036 g
Purity
99.2 %
CAS
60318-31-2

Compound Identifiers & Properties

CAS
60318-31-2
PubChem CID
138400206
SMILES
CC1=C(C2=NC1=CC3=NC(=CC4=C([C@](C(=CC5=NC(=C2)C(=C5C)CCC(=O)O)N4)(C)CC(=O)O)[O-])[C@@](C3=O)(C)CC(=O)O)CCC(=O)[O-].[Fe+2]
Canonical SMILES
CC1=C(CCC(=O)O)C2=CC3=NC(=CC4=NC(=CC5=C([O-])[C@](C)(CC(=O)O)C(=CC1=N2)N5)[C@@](C)(CC(=O)O)C4=O)C(C)=C3CCC(=O)[O-].[Fe+2]

Names & Synonyms

  • DTXSID40975728
  • 60318-31-2
  • Iron(2+) 3-[(2R,17R)-12-(2-carboxyethyl)-2,17-bis(carboxymethyl)-3-hydroxy-2,7,13,17-tetramethyl-18-oxo-17,18-dihydro-2H-porphin-22-id-8-yl]propanoate
  • Iron(2+) 3-[12-(2-carboxyethyl)-2,17-bis(carboxymethyl)-3-hydroxy-2,7,13,17-tetramethyl-18-oxo-17,18-dihydro-2H-porphin-22-id-8-yl]propanoate