| SpectraBase Compound ID | Dm38YHN1AfH |
|---|---|
| InChI | InChI=1S/C97H87NO27/c1-2-75(99)98-57-35-3-4-36-58-110-95-82(121-92(107)69-51-29-12-30-52-69)80(119-90(105)67-47-25-10-26-48-67)77(73(114-95)60-112-86(101)63-39-17-6-18-40-63)124-97-84(123-94(109)71-55-33-14-34-56-71)81(120-91(106)68-49-27-11-28-50-68)78(74(116-97)61-113-87(102)64-41-19-7-20-42-64)125-96-83(122-93(108)70-53-31-13-32-54-70)79(118-89(104)66-45-23-9-24-46-66)76(117-88(103)65-43-21-8-22-44-65)72(115-96)59-111-85(100)62-37-15-5-16-38-62/h2,5-34,37-56,72-74,76-84,95-97H,1,3-4,35-36,57-61H2,(H,98,99)/t72-,73+,74+,76+,77+,78-,79+,80-,81-,82+,83-,84+,95?,96-,97-/m1/s1 |
| InChIKey | FOPUYRGIENJRSE-SNRCAJMMSA-N |
| Mol Weight | 1698.7 g/mol |
| Molecular Formula | C97H87NO27 |
| Exact Mass | 1697.546547 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ATA8yqao6R7 |
|---|---|
| Name | #9;6-(ACRYLOYLAMINO)-1-HEXYL-O-(2,3,4,6-TETRA-O-BENZOYL-ALPHA-D-GALACTOPYRANOSYL)-(1->4)-O-(2,3,6-TRI-O-BENZOYL-BETA-D-GALACTOPYRANOSYL)-(1->4)-O-2,3,6-TRI-O-B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C97H87NO27 |
| InChI | InChI=1S/C97H87NO27/c1-2-75(99)98-57-35-3-4-36-58-110-95-82(121-92(107)69-51-29-12-30-52-69)80(119-90(105)67-47-25-10-26-48-67)77(73(114-95)60-112-86(101)63-39-17-6-18-40-63)124-97-84(123-94(109)71-55-33-14-34-56-71)81(120-91(106)68-49-27-11-28-50-68)78(74(116-97)61-113-87(102)64-41-19-7-20-42-64)125-96-83(122-93(108)70-53-31-13-32-54-70)79(118-89(104)66-45-23-9-24-46-66)76(117-88(103)65-43-21-8-22-44-65)72(115-96)59-111-85(100)62-37-15-5-16-38-62/h2,5-34,37-56,72-74,76-84,95-97H,1,3-4,35-36,57-61H2,(H,98,99)/t72-,73+,74+,76+,77+,78-,79+,80-,81-,82+,83-,84+,95?,96-,97-/m1/s1 |
| InChIKey | FOPUYRGIENJRSE-SNRCAJMMSA-N |
| Literature Reference Author | J.M.GARGANO,T.NGO,J.Y.KIM,D.W.K.ACHESON,W.J.LEES |
| Literature Reference Citation | J.AM.CHEM.SOC.,123,12909(2001) |
| Literature Reference DOI | 10.1021/ja016305a |
| Molecular Weight | 1698.748 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN28223 |