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Product Overview

Product Code

TRC-C379875

CAS Number

519-62-0

Product Format

Neat

Molecular Formula

C55 H70 Mg N4 O6

Molecular Weight

907.47

API Family

Chlorophyll

Product Categories

TRC, Pharmaceutical Toxicology Reference Materials , Impurity Reference Materials

Product Type

Impurity

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Product Information

Chemical Data

Analyte Name

Chlorophyll B

CAS Number

519-62-0

Molecular Formula

C55 H70 Mg N4 O6

Molecular Weight

907.47

Accurate Mass

906.5146

SMILES

CCC1=C(C=O)C2=N/C/1=C\c3c(C)c4C(=O)[C@H](C(=O)OC)\C\5=C/6\N=C(\C=C\7/N([Mg]n3c45)\C(=C/2)\C(=C7C)C=C)[C@@H](C)[C@@H]6CCC(=O)OC\C=C(/C)\CCC[C@H](C)CCC[C@H](C)CCCC(C)C

InChI

InChI=1S/C55H71N4O6.Mg/c1-12-38-35(8)42-27-43-36(9)40(23-24-48(61)65-26-25-34(7)22-16-21-33(6)20-15-19-32(5)18-14-17-31(3)4)52(58-43)50-51(55(63)64-11)54(62)49-37(10)44(59-53(49)50)28-46-39(13-2)41(30-60)47(57-46)29-45(38)56-42;/h12,25,27-33,36,40,51H,1,13-24,26H2,2-11H3,(H-,56,57,58,59,60,62);/q-1;+2/p-1/b34-25+;/t32-,33-,36+,40+,51-;/m1./s1

IUPAC

magnesium;methyl (3R,22S)-16-ethenyl-11-ethyl-4-hydroxy-12,17,21,26-tetramethyl-22-[3-oxo-3-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enoxy]propyl]-23,25-diazonia-7,24-diazanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(23),2(6),4,8(26),9,11,13(25),14,16,18,20-undecaene-3-carboxylate

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Chlorophyll

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Chlorophyll b (Technical Grade)

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