| SpectraBase Compound ID | K4c2eeHijNh |
|---|---|
| InChI | InChI=1S/C56H53NO18/c1-31-40(67-48(59)34-20-10-5-11-21-34)39(58)43(70-51(62)37-26-16-8-17-27-37)53(64-31)73-46-44(71-52(63)38-28-18-9-19-29-38)41(68-49(60)35-22-12-6-13-23-35)32(2)65-54(46)72-45-42(69-50(61)36-24-14-7-15-25-36)33(3)66-55-47(45)74-56(4,30-57)75-55/h5-29,31-33,39-47,53-55,58H,1-4H3/t31-,32-,33-,39+,40-,41-,42-,43+,44+,45+,46+,47+,53-,54-,55+,56+/m1/s1 |
| InChIKey | ZSXUDKHCILJPBK-GUXURRQFSA-N |
| Mol Weight | 1028.0 g/mol |
| Molecular Formula | C56H53NO18 |
| Exact Mass | 1027.326264 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DuoFdfpdpvr |
|---|---|
| Name | O-(2,4-DI-O-BENZOYL-ALPHA-D-RHAMNOPYRANOSYL)-(1->2)-O-(3,4-DI-O-BENZOYL-ALPHA-D-RHAMNOPYRANOSYL)-(1->3)-4-O-BENZOYL-1,2-O-(1-CYANOETHYLIDENE)-BETA-D-RHAMNOPYRANOSE |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C56H53NO18 |
| InChI | InChI=1S/C56H53NO18/c1-31-40(67-48(59)34-20-10-5-11-21-34)39(58)43(70-51(62)37-26-16-8-17-27-37)53(64-31)73-46-44(71-52(63)38-28-18-9-19-29-38)41(68-49(60)35-22-12-6-13-23-35)32(2)65-54(46)72-45-42(69-50(61)36-24-14-7-15-25-36)33(3)66-55-47(45)74-56(4,30-57)75-55/h5-29,31-33,39-47,53-55,58H,1-4H3/t31-,32-,33-,39+,40-,41-,42-,43+,44+,45+,46+,47+,53-,54-,55+,56+/m1/s1 |
| InChIKey | ZSXUDKHCILJPBK-GUXURRQFSA-N |
| Instrument Name | Bruker WM-250 |
| Literature Reference | YU.E.TSVETKOV, A.V.BUKHAROV, L.V.BAKINOVSKY, N.K.KOCHETKOV (1989)Bioorganich.Khim.(Russ. Lang.): v.15, N2, 231-248. |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |