Cas no 15611-43-5 (Magnesate(3-),[(7S,8S)-3-carboxy-5-(carboxymethyl)-13-ethenyl-18-ethyl-7,8-dihydro-2,8,12,17-tetramethyl-21H,23H-porphine-7-propanoato(5-)-kN21,kN22,kN23,kN24]-, hydrogen (1:3), (SP-4-2)-)
![Magnesate(3-),[(7S,8S)-3-carboxy-5-(carboxymethyl)-13-ethenyl-18-ethyl-7,8-dihydro-2,8,12,17-tetramethyl-21H,23H-porphine-7-propanoato(5-)-kN21,kN22,kN23,kN24]-, hydrogen (1:3), (SP-4-2)- structure](https://ossimg.kuujia.com/scimg/16000/15611-43-5x500.png)
15611-43-5 structure
Product Name:Magnesate(3-),[(7S,8S)-3-carboxy-5-(carboxymethyl)-13-ethenyl-18-ethyl-7,8-dihydro-2,8,12,17-tetramethyl-21H,23H-porphine-7-propanoato(5-)-kN21,kN22,kN23,kN24]-, hydrogen (1:3), (SP-4-2)-
CAS No:15611-43-5
MF:C34H34MgN4O6
MW:618.961968898773
CID:173570
PubChem ID:123798
Update Time:2025-04-19
Magnesate(3-),[(7S,8S)-3-carboxy-5-(carboxymethyl)-13-ethenyl-18-ethyl-7,8-dihydro-2,8,12,17-tetramethyl-21H,23H-porphine-7-propanoato(5-)-kN21,kN22,kN23,kN24]-, hydrogen (1:3), (SP-4-2)- Chemical and Physical Properties
Names and Identifiers
-
- Magnesate(3-),[(7S,8S)-3-carboxy-5-(carboxymethyl)-13-ethenyl-18-ethyl-7,8-dihydro-2,8,12,17-tetramethyl-21H,23H-porphine-7-propanoato(5-)-kN21,kN22,kN23,kN24]-, hydrogen (1:3), (SP-4-2)-
- MAGNESIUM CHLOROPHYLLIN
- MAGNESIUM CHLOROPHYLLIN, 13-98
- magnesium,[18-(2-carboxyethyl)-20-(carboxymethyl)-12-ethenyl-7-ethyl-3,8,13,17-tetramethyl-18,23-dihydro-17H-porphyrin-2-ylidene]methanediolate
- ALPHA-CHLOROPHYLLIN
- magnesium [3-(2-carboxyethyl)-5-(carboxymethyl)-17-ethenyl-12-ethyl-2,8,13,18-tetramethyl-2H,3H-porphin-7(24H)-ylidene]methanediolate
- magnesium;3-[18-[bis(oxidanidyl)methylidene]-8-ethenyl-13-ethyl-3,7,12,17-tetramethyl-20-(2-oxidanidyl-2-oxidanylidene-ethyl)-2,3-dihydroporphyrin-23-id-2-yl]propanoate;hydron
- Magnesate(3-), ((7S,8S)-3-carboxy-5-(carboxymethyl)-13-ethenyl-18-ethyl-7,8-dihydro-2,8,12,17-tetramethyl-21H,23H-porphine-7-propanoato(5-)-kappa,N21,kappaN22,kappaN23,kappaN24)-, trihydrogen, (SP-4-2)-
- Q26841336
- magnesium;3-[20-(carboxylatomethyl)-18-(dioxidomethylidene)-8-ethenyl-13-ethyl-3,7,12,17-tetramethyl-2,3-dihydroporphyrin-23-id-2-yl]propanoate;hydron
- Magnesate(3-), (18-carboxy-20-(carboxymethyl)-8-ethenyl-13-ethyl-2,3-dihydro-3,7,12,17-tetramethyl-21H,23H-porphine-2-propanoato(5-)-N(21),N(22),N(23),N(24))-, trihydrogen, (SP-4-2-(2S-trans))-
- Chlorophyllin A
- 15611-43-5
- DTXSID90872455
- CCRIS 8573
-
- Inchi： 1S/C34H36N4O6.Mg/c1-7-19-15(3)23-12-25-17(5)21(9-10-29(39)40)32(37-25)22(11-30(41)42)33-31(34(43)44)18(6)26(38-33)14-28-20(8-2)16(4)24(36-28)13-27(19)35-23;/h7,12-14,17,21H,1,8-11H2,2-6H3,(H5,35,36,37,38,39,40,41,42,43,44);/q;+2/p-2
- InChI Key： UVOXKYYHMDAWNK-UHFFFAOYSA-L
- SMILES： [Mg+2].[O-]C(CCC1C2=C(CC(=O)[O-])C3/C(=C(\[O-])/[O-])/C(C)=C(C=C4C(CC)=C(C)C(=CC5C(C=C)=C(C)C(=CC(C1C)=N2)N=5)[N-]4)N=3)=O.[H+].[H+].[H+] |c:5,t:19,26,34|
Computed Properties
- Exact Mass: 618.23302
- Monoisotopic Mass: 723.123
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 10
- Heavy Atom Count: 48
- Rotatable Bond Count: 5
- Complexity: 1760
- Covalently-Bonded Unit Count: 5
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 165A^2
Experimental Properties
- Density: g/cm3
- Boiling Point: 801.6°Cat760mmHg
- Flash Point: 438.6 °C
- PSA: 169.83
Magnesate(3-),[(7S,8S)-3-carboxy-5-(carboxymethyl)-13-ethenyl-18-ethyl-7,8-dihydro-2,8,12,17-tetramethyl-21H,23H-porphine-7-propanoato(5-)-kN21,kN22,kN23,kN24]-, hydrogen (1:3), (SP-4-2)- Related Literature
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
-
Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
-
Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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