Chemical Compound

J676.539D

CAS Registry Number 54090-88-9
J676.539D chemical structure
Primary Record

J676.539D

In stock
3,419 g
Purity
98.8 %
CAS
54090-88-9

Compound Identifiers & Properties

CAS
54090-88-9
PubChem CID
14818903
SMILES
CC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)CCC(=O)OC)C)CCC(=O)OC)C)CCC(=O)OC)CC(=O)OC)CCC(=O)OC
Canonical SMILES
COC(=O)CCC1=C(C)c2cc3[nH]c(cc4[nH]c(cc5nc(cc1n2)C(C)=C5CCC(=O)OC)c(C)c4CCC(=O)OC)c(CC(=O)OC)c3CCC(=O)OC

Names & Synonyms

  • J676.539D
  • PENTACARBOXYLPORPHYRINIPENTAMETHYLESTER
  • PENTACARBOXYLPORPHYRIN I PENTAMETHYL ESTER
  • 54090-88-9
  • 2,7,12-Trimethyl-17-(methoxycarbonylmethyl)-21H,23H-porphyrin-3,8,13,18-tetrakis(propanoic acid methyl) ester
  • methyl 3-[15-(2-methoxy-2-oxoethyl)-9,14,19-tris(3-methoxy-3-oxopropyl)-5,10,20-trimethyl-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1(20),2,4,6(24),7,9,11,13(22),14,16,18-undecaen-4-yl]propanoate