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3,8,13,18-Tetrakis(carboxymethyl)-5,10,15,22,23,24-hexahydro-19-(hydroxymethyl)-21H-biline-2,7,12,17-tetrapropanoic acid

HCID 788
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Basic information

CAS
71861-60-4
Standard SMILES
O=C(O)CCc1c[nH]c(Cc2[nH]c(Cc3[nH]c(Cc4[nH]c(CO)c(CC(=O)O)c4CCC(=O)O)c(CC(=O)O)c3CCC(=O)O)c(CC(=O)O)c2CCC(=O)O)c1CC(=O)O
InChIKey
WDFJYRZCZIUBPR-UHFFFAOYSA-N
Molecular formula
C40H46N4O17
Average molar mass
854.819 g/mol
Monoisotopic mass
854.28579601

Names & identifiers

Preferred name
3,8,13,18-Tetrakis(carboxymethyl)-5,10,15,22,23,24-hexahydro-19-(hydroxymethyl)-21H-biline-2,7,12,17-tetrapropanoic acid

Database identifiers

CAS
71861-60-4
PubChem CID
788
DTXSID
DTXSID001105025
ChEMBL
CHEMBL273676
ChEBI
CHEBI:16645
Nikkaji
J618.630K

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