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16053-68-2 | 21H,23H-Porphine-2,18-dipropanoic acid, 7,12-diethenyl-3,8,13,17-tetramethyl-, 2-methyl ester
CAS No: 16053-68-2 Catalog No: AG001S0C MDL No:
Product Description
Catalog Number:
AG001S0C
Chemical Name:
21H,23H-Porphine-2,18-dipropanoic acid, 7,12-diethenyl-3,8,13,17-tetramethyl-, 2-methyl ester
CAS Number:
16053-68-2
Molecular Formula:
C35H36N4O4
Molecular Weight:
576.6847
IUPAC Name:
3-[8,13-bis(ethenyl)-18-(3-methoxy-3-oxopropyl)-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoic acid
InChI:
InChI=1S/C35H36N4O4/c1-8-22-18(3)26-14-27-20(5)24(10-12-34(40)41)32(38-27)17-33-25(11-13-35(42)43-7)21(6)29(39-33)16-31-23(9-2)19(4)28(37-31)15-30(22)36-26/h8-9,14-17,36-37H,1-2,10-13H2,3-7H3,(H,40,41)
InChI Key:
QFOYLAGRMXUVSR-UHFFFAOYSA-N
SMILES:
COC(=O)CCC1=C(C)C2=NC1=Cc1[nH]c(c(c1CCC(=O)O)C)C=C1N=C(C=c3[nH]c(=C2)c(C=C)c3C)C(=C1C)C=C
Properties
Complexity:
1020
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
576.274g/mol
Formal Charge:
0
Heavy Atom Count:
43
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
576.697g/mol
Monoisotopic Mass:
576.274g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
Literature
| Title | Journal |
|---|---|
| A new method for isolating physiologically active Mg-protoporphyrin monomethyl ester, the substrate of the cyclase enzyme of the chlorophyll biosynthetic pathway. | Plant physiology and biochemistry : PPB 20071201 |
| Transient kinetics of the reaction catalysed by magnesium protoporphyrin IX methyltransferase. | The Biochemical journal 20040915 |
| Intracellular signalling: the language of the chloroplast. | Current biology : CB 20030415 |
| Light activates binding of membrane proteins to chloroplast RNAs in Chlamydomonas reinhardtii. | Plant molecular biology 20021001 |
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