Molecule
Name
Chlorophyllin sodium copper salt
IUPAC name
copper;trisodium;18-(2-carboxylatoethyl)-20-(carboxylatomethyl)-12-ethenyl-7-ethyl-3,8,13,17-tetramethyl-17,18-dihydroporphyrin-21,23-diide-2-carboxylate
Secondary names
Chlorophyllin, coppered trisodium salt
InChI
InChI=1S/C34H36N4O6.Cu.3Na/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;3*+1/p-5
InChI key
HWDGVJUIHRPKFR-UHFFFAOYSA-I
CAS number
11006-34-1
Structure and atomic composition
Formula
C34H31O3O3Na3N4Cu
Chemical formula
C34H31O3(O-)3(Na+)3N2(N-)2(Cu2+)
Structural formula
CCC1=C(C2=NC1=CC3=C(C(=C([N-]3)C(=C4C(C(C(=N4)C=C5C(=C(C(=C2)[N-]5)C=C)C)C)CCC(=O)[O-])CC(=O)[O-])C(=O)[O-])C)C.[Na+].[Na+].[Na+].[Cu+2]
Charge
0
Unpaired electrons
0
  Atom Name Number
C Carbon 34
H Hydrogen 31
O Oxygen 3
N Nitrogen 2
Na Sodium 3
N− Nitrogen anion 2
O− Oxide anion 3
Na+ Sodium cation 3
Cu2+ Copper cation 1
Relations
  • no
Isotope mixture type
terrestrial abundance
Spin type
equilibrated
Molar mass
724.159 g/mol
State STP
solid
Protic
protic
Polarity
nonpolar
Molecule symmetry
no
Case
complex
Chemical functions
  Function Number
R=CH2 1
R−CH3 3
R−CH2−CH3 1
R−C(=O)−O− 3
Chemical bonds
  Bond Number
≥C−C≤ 24
>C=C< 8
≥C−H 31
⪖ 4
\eqslantgtr C-N= 2
>C=N- 2
>C=O 3
\eqslantgtr C-O^- 3
Na^+ \cdot O^{-}- 3
\cdot Cu^{2+} \cdot N^{-}< 2