| SpectraBase Compound ID | 95op8xnis1o |
|---|---|
| InChI | InChI=1S/C46H61NO21/c1-24-36(65-42(55)28-16-10-7-11-17-28)40(66-43(56)29-18-12-8-13-19-29)35(54)45(61-24)68-41-34(53)37(58-6)30(22-48)63-46(41)67-39-33(47-25(2)49)44(59-21-15-9-14-20-32(52)57-5)64-31(23-60-26(3)50)38(39)62-27(4)51/h7-8,10-13,16-19,24,30-31,33-41,44-46,48,53-54H,9,14-15,20-23H2,1-6H3,(H,47,49)/t24-,30+,31-,33-,34-,35-,36+,37-,38+,39-,40-,41+,44+,45-,46-/m1/s1 |
| InChIKey | FVICUBDCJJXICR-GVGKLAGLSA-N |
| Mol Weight | 964.0 g/mol |
| Molecular Formula | C46H61NO21 |
| Exact Mass | 963.373608 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DhOhNtxycAP |
|---|---|
| Name | #16;5-(METHOXYCARBONYL)-PENTYL-3,4-DI-O-BENZOYL-ALPHA-L-FUCOPYRANOSYL-(1->2)-4-O-METHYL-BETA-D-GALACTOPYRANOSYL-(1->3)-4,6-DI-O-ACETYL-2-ACETAMIDE-2-DEOXY-ALPH |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H61NO21 |
| InChI | InChI=1S/C46H61NO21/c1-24-36(65-42(55)28-16-10-7-11-17-28)40(66-43(56)29-18-12-8-13-19-29)35(54)45(61-24)68-41-34(53)37(58-6)30(22-48)63-46(41)67-39-33(47-25(2)49)44(59-21-15-9-14-20-32(52)57-5)64-31(23-60-26(3)50)38(39)62-27(4)51/h7-8,10-13,16-19,24,30-31,33-41,44-46,48,53-54H,9,14-15,20-23H2,1-6H3,(H,47,49)/t24-,30+,31-,33-,34-,35-,36+,37-,38+,39-,40-,41+,44+,45-,46-/m1/s1 |
| InChIKey | FVICUBDCJJXICR-GVGKLAGLSA-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 | 963.984 g/mol |
| Sample ID | 1325 |
| Solvent | CDCl3 |