Dimethyl 3-hydroxy-2-[(methoxycarbonyl)methyl]-2,7,12,18-tetramethyl-2,3-dihydro-porphyrine-13,17-diyl-dipropionate

SpectraBase Compound ID	7mbIS9YorvN
InChI	InChI=1S/C35H40N4O7/c1-18-12-21-13-25-19(2)22(8-10-31(40)44-5)27(37-25)15-28-23(9-11-32(41)45-6)20(3)26(38-28)16-30-35(4,17-33(42)46-7)34(43)29(39-30)14-24(18)36-21/h12-16,34,37,39,43H,8-11,17H2,1-7H3/b21-13-,28-15-,29-14-,30-16-/t34-,35-/m1/s1
InChIKey	YFBLTPFYQPIYDC-WMQPYXGISA-N Google Search
Mol Weight	628.7 g/mol
Molecular Formula	C35H40N4O7
Exact Mass	628.2897 g/mol

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SpectraBase Spectrum ID	6kIadw0O8D2
Name	Dimethyl 3-hydroxy-2-[(methoxycarbonyl)methyl]-2,7,12,18-tetramethyl-2,3-dihydro-porphyrine-13,17-diyl-dipropionate
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	628.289699637 u
Formula	C35H40N4O7
InChI	InChI=1S/C35H40N4O7/c1-18-12-21-13-25-19(2)22(8-10-31(40)44-5)27(37-25)15-28-23(9-11-32(41)45-6)20(3)26(38-28)16-30-35(4,17-33(42)46-7)34(43)29(39-30)14-24(18)36-21/h12-16,34,37,39,43H,8-11,17H2,1-7H3/b21-13-,28-15-,29-14-,30-16-/t34-,35-/m1/s1
InChIKey	YFBLTPFYQPIYDC-WMQPYXGISA-N
Molecular Weight	628.726 g/mol
SMILES	C=12[C@]([C@](O)(C(N2)=CC2=NC(=CC=3NC(C=C4N=C(C1)C(=C4CCC(=O)OC)C)=C(C3C)CCC(=O)OC)C=C2C)[H])(CC(=O)OC)C