| SpectraBase Compound ID | 2jBNShHqNia |
|---|---|
| InChI | InChI=1S/C36H48O20/c1-15-25(43)28(46)33(56-35-29(47)27(45)26(44)22(13-37)52-35)36(51-15)55-32-30(48)34(50-10-9-17-3-6-18(39)20(41)11-17)53-23(14-38)31(32)54-24(42)8-5-16-4-7-19(40)21(12-16)49-2/h3-8,11-12,15,22-23,25-41,43-48H,9-10,13-14H2,1-2H3/b8-5+/t15-,22+,23-,25-,26+,27-,28+,29+,30-,31-,32-,33+,34-,35-,36-/m0/s1 |
| InChIKey | BZQWSSOAOXGBAN-TZEKGJHQSA-N |
| Mol Weight | 800.8 g/mol |
| Molecular Formula | C36H48O20 |
| Exact Mass | 800.273894 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DMuXFg8Klpr |
|---|---|
| Name | INCANOSIDE-C;1-O-(3,4-DIHYDROXYPHENYL)-ETHYL-O-BETA-D-GLUCOPYRANOSYL-(1->2)-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-4-O-FERULOYL-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H48O20 |
| InChI | InChI=1S/C36H48O20/c1-15-25(43)28(46)33(56-35-29(47)27(45)26(44)22(13-37)52-35)36(51-15)55-32-30(48)34(50-10-9-17-3-6-18(39)20(41)11-17)53-23(14-38)31(32)54-24(42)8-5-16-4-7-19(40)21(12-16)49-2/h3-8,11-12,15,22-23,25-41,43-48H,9-10,13-14H2,1-2H3/b8-5+/t15-,22+,23-,25-,26+,27-,28+,29+,30-,31-,32-,33+,34-,35-,36-/m0/s1 |
| InChIKey | BZQWSSOAOXGBAN-TZEKGJHQSA-N |
| Literature Reference Author | J.GAO,K.IGARASHI,M.NUKINA |
| Literature Reference Citation | CHEM.PHARM.BULL.,48,1075(2000) |
| Literature Reference DOI | 10.1248/cpb.48.1075 |
| Molecular Weight | 800.765 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVN4397 |