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5-[4-[3-(2,3,6,2,3,4,6-HEPTA-O-ACETYL-BETA-D-LACTOSYLOXY)-PROPYLOXY]-PHENYL]-10,15,20-TRITOLYLPORPHYRINE
SpectraBase Compound ID CyKi8Ao0j2U
InChI InChI=1S/C76H76N4O19/c1-40-12-18-50(19-13-40)65-55-28-30-57(77-55)66(51-20-14-41(2)15-21-51)59-32-34-61(79-59)68(62-35-33-60(80-62)67(58-31-29-56(65)78-58)52-22-16-42(3)17-23-52)53-24-26-54(27-25-53)88-36-11-37-89-75-73(95-48(9)86)72(94-47(8)85)70(64(97-75)39-91-44(5)82)99-76-74(96-49(10)87)71(93-46(7)84)69(92-45(6)83)63(98-76)38-90-43(4)81/h12-35,63-64,69-77,80H,11,36-39H2,1-10H3/b65-55-,65-56-,66-57-,66-59-,67-58-,67-60-,68-61-,68-62-/t63-,64-,69+,70-,71+,72+,73-,74-,75-,76+/m1/s1
InChIKey FWHPCQYJSKDYQF-SPABIJQXSA-N
Mol Weight 1349.5 g/mol
Molecular Formula C76H76N4O19
Exact Mass 1348.510376 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5tTO1GCZoEN
Name 5-[4-[3-(2,3,6,2,3,4,6-HEPTA-O-ACETYL-BETA-D-LACTOSYLOXY)-PROPYLOXY]-PHENYL]-10,15,20-TRITOLYLPORPHYRINE
Compound Number 15B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C76H76N4O19
InChI InChI=1S/C76H76N4O19/c1-40-12-18-50(19-13-40)65-55-28-30-57(77-55)66(51-20-14-41(2)15-21-51)59-32-34-61(79-59)68(62-35-33-60(80-62)67(58-31-29-56(65)78-58)52-22-16-42(3)17-23-52)53-24-26-54(27-25-53)88-36-11-37-89-75-73(95-48(9)86)72(94-47(8)85)70(64(97-75)39-91-44(5)82)99-76-74(96-49(10)87)71(93-46(7)84)69(92-45(6)83)63(98-76)38-90-43(4)81/h12-35,63-64,69-77,80H,11,36-39H2,1-10H3/b65-55-,65-56-,66-57-,66-59-,67-58-,67-60-,68-61-,68-62-/t63-,64-,69+,70-,71+,72+,73-,74-,75-,76+/m1/s1
InChIKey FWHPCQYJSKDYQF-SPABIJQXSA-N
Literature Reference Author O.GAUD,R.GRANET,M.KAOUADJI,P.KRAUSZ,J.C.BLAIS,G.BOLBACH
Literature Reference Citation CAN.J.CHEM.,74,481(1996)
Literature Reference DOI 10.1139/v96-053
Molecular Weight 1349.455 g/mol
Solvent CDCl3
Source File Reference UWRK3195