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
$C_{34}H_{31}O_3O_3Na_3N_4Cu$
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
$Cu^{2+}$ 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
$R=CH_2$ 1
$R-CH_3$ 3
$R-CH_2-CH_3$ 1
$R-C(=O)-O^-$ 3
Chemical bonds
  Bond Number
$\geq C-C \leq$ 24
$>C=C<$ 8
$\geq C-H$ 31
$\eqslantgtr C-N^-$ 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