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Chemical structure of Mesoporphyrin IX dihydrochloride

GC76924

Mesoporphyrin IX dihydrochloride

Also known as 3-[18-(2-carboxyethyl)-8,13-diethyl-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoic acid;dihydrochloride

Mesoporphyrin IX (dihydrochloride) is a photosensitizer that can be used to modify liposomes

ChemicalCAS68938-72-7MW639.61FormulaC34H40Cl2N4O4
CAS number
68938-72-7
Molecular weight
639.61
Formula
C34H40Cl2N4O4
InChIKey
YUIUEEROGVTICN-UHFFFAOYSA-N
Catalogue number
GC76924
Brand
GLPBIO
Computed properties PubChem CID 111858 · TPSA 132 Ų · H-bond donors 6 · H-bond acceptors 6
TPSA
132 Ų
H-bond donors
6
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
44

SMILES CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)C)CCC(=O)O)CCC(=O)O)C)C)CC)C.Cl.Cl

Computed descriptors from PubChem (CID 111858), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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