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Details

Stereochemistry ABSOLUTE
Molecular Formula C55H70N4O6.Mg
Molecular Weight 907.4725
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CHLOROPHYLL B

SMILES

[Mg++].CCC1=C(C=O)C2=NC1=CC3=C(C)C4=C([N-]3)C([C@@H](C(=O)OC)C4=O)=C5N=C(C=C6[N-]C(=C2)C(C=C)=C6C)[C@@H](C)[C@@H]5CCC(=O)OC\C=C(/C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C

InChI

InChIKey=NSMUHPMZFPKNMZ-VBYMZDBQSA-M
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

HIDE SMILES / InChI

Approval Year