![#12;4-O-ACETYL-DIOXYXYLENE-[METHYL-(5-ACETAMIDO-4,7,8,9-TETRA-O-ACETYL-3,5-DIDEOXY-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSYL)-ONATE]-(2->3)-O-(2,4,6-TRI-O-AC](/api/spectrum/9wbWF2AAHUc/structure.png?h=300&w=458 "#12;4-O-ACETYL-DIOXYXYLENE-[METHYL-(5-ACETAMIDO-4,7,8,9-TETRA-O-ACETYL-3,5-DIDEOXY-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSYL)-ONATE]-(2->3)-O-(2,4,6-TRI-O-AC")
| SpectraBase Compound ID | DDgLCQ5eEtk |
|---|---|
| InChI | InChI=1S/C74H88N2O30Si/c1-39(77)34-93-50-31-29-49(30-32-50)35-94-70-60(76-68(87)53-27-21-22-28-54(53)69(76)88)65(100-47(9)85)62(58(102-70)38-95-107(73(11,12)13,51-23-17-15-18-24-51)52-25-19-16-20-26-52)104-71-67(101-48(10)86)66(63(99-46(8)84)57(103-71)37-92-42(4)80)106-74(72(89)90-14)33-55(96-43(5)81)59(75-40(2)78)64(105-74)61(98-45(7)83)56(97-44(6)82)36-91-41(3)79/h15-32,55-67,70-71H,33-38H2,1-14H3,(H,75,78)/t55-,56-,57-,58-,59+,60-,61+,62-,63+,64+,65-,66+,67-,70-,71+,74-/m0/s1 |
| InChIKey | SCPSATMBIBRBMT-BLBJASKJSA-N |
| Mol Weight | 1513.6 g/mol |
| Molecular Formula | C74H88N2O30Si |
| Exact Mass | 1512.519116 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9wbWF2AAHUc |
|---|---|
| Name | #12;4-O-ACETYL-DIOXYXYLENE-[METHYL-(5-ACETAMIDO-4,7,8,9-TETRA-O-ACETYL-3,5-DIDEOXY-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSYL)-ONATE]-(2->3)-O-(2,4,6-TRI-O-AC |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C74H88N2O30Si |
| InChI | InChI=1S/C74H88N2O30Si/c1-39(77)34-93-50-31-29-49(30-32-50)35-94-70-60(76-68(87)53-27-21-22-28-54(53)69(76)88)65(100-47(9)85)62(58(102-70)38-95-107(73(11,12)13,51-23-17-15-18-24-51)52-25-19-16-20-26-52)104-71-67(101-48(10)86)66(63(99-46(8)84)57(103-71)37-92-42(4)80)106-74(72(89)90-14)33-55(96-43(5)81)59(75-40(2)78)64(105-74)61(98-45(7)83)56(97-44(6)82)36-91-41(3)79/h15-32,55-67,70-71H,33-38H2,1-14H3,(H,75,78)/t55-,56-,57-,58-,59+,60-,61+,62-,63+,64+,65-,66+,67-,70-,71+,74-/m0/s1 |
| InChIKey | SCPSATMBIBRBMT-BLBJASKJSA-N |
| Literature Reference Author | S.MEHTA,M.GILBERT,W.W.WAKARCHUK,D.M.WHITFIELD |
| Literature Reference Citation | ORG.LETTERS,2,751(2000) |
| Literature Reference DOI | 10.1021/ol990406k |
| Molecular Weight | 1513.594 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU33366 |