![5,10,15-TRI-[4-(2,3,4,6-TETRA-O-ACETYL)-GLUCOSYLOXYPROPYLOXYPHENYL]-20-TOLYLPORPHYRINE](/api/spectrum/J7jEa8EtTP8/structure.png?h=300&w=458 "5,10,15-TRI-[4-(2,3,4,6-TETRA-O-ACETYL)-GLUCOSYLOXYPROPYLOXYPHENYL]-20-TOLYLPORPHYRINE")
| SpectraBase Compound ID | CZWEkz46DvF |
|---|---|
| InChI | InChI=1S/C96H104N4O33/c1-50-17-19-63(20-18-50)81-70-33-35-72(97-70)82(64-21-27-67(28-22-64)113-41-14-44-116-94-91(128-60(11)110)88(125-57(8)107)85(122-54(5)104)78(131-94)47-119-51(2)101)74-37-39-76(99-74)84(66-25-31-69(32-26-66)115-43-16-46-118-96-93(130-62(13)112)90(127-59(10)109)87(124-56(7)106)80(133-96)49-121-53(4)103)77-40-38-75(100-77)83(73-36-34-71(81)98-73)65-23-29-68(30-24-65)114-42-15-45-117-95-92(129-61(12)111)89(126-58(9)108)86(123-55(6)105)79(132-95)48-120-52(3)102/h17-40,78-80,85-97,100H,14-16,41-49H2,1-13H3/b81-70-,81-71-,82-72-,82-74-,83-73-,83-75-,84-76-,84-77-/t78-,79+,80-,85-,86+,87-,88+,89-,90+,91-,92+,93-,94-,95+,96-/m0/s1 |
| InChIKey | MQTLLDRCFFFHFJ-FEJSBPFASA-N |
| Mol Weight | 1841.9 g/mol |
| Molecular Formula | C96H104N4O33 |
| Exact Mass | 1840.658282 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J7jEa8EtTP8 |
|---|---|
| Name | 5,10,15-TRI-[4-(2,3,4,6-TETRA-O-ACETYL)-GLUCOSYLOXYPROPYLOXYPHENYL]-20-TOLYLPORPHYRINE |
| Compound Number | 21 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C96H104N4O33 |
| InChI | InChI=1S/C96H104N4O33/c1-50-17-19-63(20-18-50)81-70-33-35-72(97-70)82(64-21-27-67(28-22-64)113-41-14-44-116-94-91(128-60(11)110)88(125-57(8)107)85(122-54(5)104)78(131-94)47-119-51(2)101)74-37-39-76(99-74)84(66-25-31-69(32-26-66)115-43-16-46-118-96-93(130-62(13)112)90(127-59(10)109)87(124-56(7)106)80(133-96)49-121-53(4)103)77-40-38-75(100-77)83(73-36-34-71(81)98-73)65-23-29-68(30-24-65)114-42-15-45-117-95-92(129-61(12)111)89(126-58(9)108)86(123-55(6)105)79(132-95)48-120-52(3)102/h17-40,78-80,85-97,100H,14-16,41-49H2,1-13H3/b81-70-,81-71-,82-72-,82-74-,83-73-,83-75-,84-76-,84-77-/t78-,79+,80-,85-,86+,87-,88+,89-,90+,91-,92+,93-,94-,95+,96-/m0/s1 |
| InChIKey | MQTLLDRCFFFHFJ-FEJSBPFASA-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 | 1841.889 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRK3196 |