| SpectraBase Compound ID | GzEsOo18CTG |
|---|---|
| InChI | InChI=1S/C37H50O20/c1-16-26(43)29(46)34(57-36-30(47)28(45)27(44)23(14-38)53-36)37(52-16)56-33-31(48)35(51-11-10-18-5-8-20(41)22(13-18)50-3)54-24(15-39)32(33)55-25(42)9-6-17-4-7-19(40)21(12-17)49-2/h4-9,12-13,16,23-24,26-41,43-48H,10-11,14-15H2,1-3H3/b9-6+/t16-,23+,24-,26-,27+,28-,29+,30+,31-,32-,33-,34+,35-,36-,37-/m0/s1 |
| InChIKey | HHYPJHIDSAPPCM-UGFGTNGJSA-N |
| Mol Weight | 814.8 g/mol |
| Molecular Formula | C37H50O20 |
| Exact Mass | 814.289544 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GVGoTdpjnu2 |
|---|---|
| Name | INCANOSIDE-E;#4;1-O-(3-METHOXY-4-HYDROXYPHENYL)-ETHYL-O-BETA-D-GLUCOPYRANOSYL-(1->2)-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-4-O-FERULOYL-BETA-D-GLUCOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H50O20 |
| InChI | InChI=1S/C37H50O20/c1-16-26(43)29(46)34(57-36-30(47)28(45)27(44)23(14-38)53-36)37(52-16)56-33-31(48)35(51-11-10-18-5-8-20(41)22(13-18)50-3)54-24(15-39)32(33)55-25(42)9-6-17-4-7-19(40)21(12-17)49-2/h4-9,12-13,16,23-24,26-41,43-48H,10-11,14-15H2,1-3H3/b9-6+/t16-,23+,24-,26-,27+,28-,29+,30+,31-,32-,33-,34+,35-,36-,37-/m0/s1 |
| InChIKey | HHYPJHIDSAPPCM-UGFGTNGJSA-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 | 814.792 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVN4399 |