| SpectraBase Compound ID | JOMj6SKRaXH |
|---|---|
| InChI | InChI=1S/C88H99NO18/c1-5-6-7-8-9-33-50-94-85-79(98-55-64-42-25-14-26-43-64)77(97-54-63-40-23-13-24-41-63)74(69(103-85)57-93-51-60-34-17-10-18-35-60)106-86-80(99-56-65-44-27-15-28-45-65)78(75-71(104-86)58-100-83(105-75)66-46-29-16-30-47-66)107-84-72(89-81(90)67-48-31-32-49-68(67)82(89)91)76(96-53-62-38-21-12-22-39-62)73(95-52-61-36-19-11-20-37-61)70(102-84)59-101-87(92)88(2,3)4/h10-32,34-49,69-80,83-86H,5-9,33,50-59H2,1-4H3/t69-,70-,71-,72-,73-,74-,75-,76-,77+,78+,79-,80+,83-,84+,85-,86+/m0/s1 |
| InChIKey | UKRPPXZPFABGLB-VNTFOJJJSA-N |
| Mol Weight | 1458.7 g/mol |
| Molecular Formula | C88H99NO18 |
| Exact Mass | 1457.686215 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AAfGcV7JlFH |
|---|---|
| Name | #15;OCTYL-3,4-DI-O-BENZYL-6-O-PIVALOYL-2-DEOXY-2-PHTHALIMIDO-BETA-D-GLUCOPYRANOSYL-(1->3)-2-O-BENZYL-4,6-O-BENZYLIDENE-BETA-D-MANNOPYRANOSYL-(1->4)-2,3,6-TRI-O |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C88H99NO18 |
| InChI | InChI=1S/C88H99NO18/c1-5-6-7-8-9-33-50-94-85-79(98-55-64-42-25-14-26-43-64)77(97-54-63-40-23-13-24-41-63)74(69(103-85)57-93-51-60-34-17-10-18-35-60)106-86-80(99-56-65-44-27-15-28-45-65)78(75-71(104-86)58-100-83(105-75)66-46-29-16-30-47-66)107-84-72(89-81(90)67-48-31-32-49-68(67)82(89)91)76(96-53-62-38-21-12-22-39-62)73(95-52-61-36-19-11-20-37-61)70(102-84)59-101-87(92)88(2,3)4/h10-32,34-49,69-80,83-86H,5-9,33,50-59H2,1-4H3/t69-,70-,71-,72-,73-,74-,75-,76-,77+,78+,79-,80+,83-,84+,85-,86+/m0/s1 |
| InChIKey | UKRPPXZPFABGLB-VNTFOJJJSA-N |
| Literature Reference Author | I.OHTSUKA,N.HADA,H.OHTAKA,M.SUGITA,T.TAKEDA |
| Literature Reference Citation | CHEM.PHARM.BULL.,50,600(2002) |
| Literature Reference DOI | 10.1248/cpb.50.600 |
| Molecular Weight | 1458.750 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN8136 |