| SpectraBase Compound ID | 9IgDX6Uqyzt |
|---|---|
| InChI | InChI=1S/C47H63NO21/c1-25-36(66-43(55)29-17-11-8-12-18-29)41(67-44(56)30-19-13-9-14-20-30)42(59-7)47(62-25)69-40-35(54)37(58-6)31(23-49)64-46(40)68-39-34(48-26(2)50)45(60-22-16-10-15-21-33(53)57-5)65-32(24-61-27(3)51)38(39)63-28(4)52/h8-9,11-14,17-20,25,31-32,34-42,45-47,49,54H,10,15-16,21-24H2,1-7H3,(H,48,50)/t25-,31+,32-,34-,35-,36+,37-,38+,39-,40+,41+,42-,45+,46-,47-/m1/s1 |
| InChIKey | XNDHHGFMHDZLLF-FQYAQALMSA-N |
| Mol Weight | 978.0 g/mol |
| Molecular Formula | C47H63NO21 |
| Exact Mass | 977.389258 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7Pp1RhKnYgo |
|---|---|
| Name | #10;5-(METHOXYCARBONYL)-PENTYL-3,4-DI-O-BENZOYL-2-O-METHYL-ALPHA-L-FUCOPYRANOSYL-(1->2)-4-O-METHYL-BETA-D-GALACTOPYRANOSYL-(1->3)-4,6-DI-O-ACETYL-2-ACETAMIDE-2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H63NO21 |
| InChI | InChI=1S/C47H63NO21/c1-25-36(66-43(55)29-17-11-8-12-18-29)41(67-44(56)30-19-13-9-14-20-30)42(59-7)47(62-25)69-40-35(54)37(58-6)31(23-49)64-46(40)68-39-34(48-26(2)50)45(60-22-16-10-15-21-33(53)57-5)65-32(24-61-27(3)51)38(39)63-28(4)52/h8-9,11-14,17-20,25,31-32,34-42,45-47,49,54H,10,15-16,21-24H2,1-7H3,(H,48,50)/t25-,31+,32-,34-,35-,36+,37-,38+,39-,40+,41+,42-,45+,46-,47-/m1/s1 |
| InChIKey | XNDHHGFMHDZLLF-FQYAQALMSA-N |
| Literature Reference Author | A.KOIZUMI,K.YAMANO,T.TSUCHIYA,F.SCHWEIZER,F.KIUCHI,N.HADA |
| Literature Reference Citation | MOLECULES,17,9023(2012) |
| Literature Reference DOI | 10.3390/molecules17089023 |
| Molecular Weight | 978.011 g/mol |
| Sample ID | 1319 |
| Solvent | CDCl3 |