Phytoporphyrin
[CAS# 26359-43-3]

Identification

• Name: Phytoporphyrin
• Synonyms: 3-Phorbinepropanoic Acid, 3,4-Didehydro-9,14-Diethyl-4,8,13,18-Tetramethyl-20-Oxo-; Phylloerythrin; Aids-058020
• Molecular Formula: C₃₃H₃₄N₄O₃
• Molecular Weight: 534.66
• CAS Registry Number: 26359-43-3
• SMILES: C(C1=C(C3=NC1=C6C5=NC(=CC2=C(C(=C([NH]2)C=C4[NH]C(=C3)C(=C4CC)C)C)CC)C(=C5C(=O)C6)C)C)CC(=O)O
• InChI: 1S/C33H34N4O3/c1-7-19-15(3)23-12-25-17(5)21(9-10-30(39)40)32(36-25)22-11-29(38)31-18(6)26(37-33(22)31)14-28-20(8-2)16(4)24(35-28)13-27(19)34-23/h12-14,34-35H,7-11H2,1-6H3,(H,39,40)
• InChIKey: USUXZIXOWFMLFE-UHFFFAOYSA-N

Properties

• Density: 1.327g/cm³ (Cal.)
• Boiling point: 1068.686°C at 760 mmHg (Cal.)
• Flash point: 600.12°C (Cal.)