| SpectraBase Compound ID | 23tizvvuK67 |
|---|---|
| InChI | InChI=1S/C35H46O20/c1-14-24(42)28(46)32(55-34-29(47)27(45)25(43)21(12-36)52-34)35(51-14)54-31-26(44)22(13-50-23(41)7-4-15-2-5-17(37)19(39)10-15)53-33(30(31)48)49-9-8-16-3-6-18(38)20(40)11-16/h2-7,10-11,14,21-22,24-40,42-48H,8-9,12-13H2,1H3/b7-4+/t14-,21+,22-,24-,25-,26-,27-,28+,29+,30-,31+,32+,33-,34-,35-/m0/s1 |
| InChIKey | PSFMBXYUQFAGAM-JDZQZSJZSA-N |
| Mol Weight | 786.7 g/mol |
| Molecular Formula | C35H46O20 |
| Exact Mass | 786.258244 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LVdXGnUDe2t |
|---|---|
| Name | #3;ALMIUSIDE-C;2-(3,4-DIHYDROXYPHENYL)-ETHYL-O-BETA-D-GALACTOPYRANOSYL-(1->2)-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-(6-O-TRANS-CAFFEOYL)-BETA-D-GLUCOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H46O20 |
| InChI | InChI=1S/C35H46O20/c1-14-24(42)28(46)32(55-34-29(47)27(45)25(43)21(12-36)52-34)35(51-14)54-31-26(44)22(13-50-23(41)7-4-15-2-5-17(37)19(39)10-15)53-33(30(31)48)49-9-8-16-3-6-18(38)20(40)11-16/h2-7,10-11,14,21-22,24-40,42-48H,8-9,12-13H2,1H3/b7-4+/t14-,21+,22-,24-,25-,26-,27-,28+,29+,30-,31+,32+,33-,34-,35-/m0/s1 |
| InChIKey | PSFMBXYUQFAGAM-JDZQZSJZSA-N |
| Literature Reference Author | N.ITO,T.NIHEI,R.KAKUDA,Y.YAOITA,M.KIKUCHI |
| Literature Reference Citation | CHEM.PHARM.BULL.,54,1705(2006) |
| Literature Reference DOI | 10.1248/cpb.54.1705 |
| Molecular Weight | 786.738 g/mol |
| Sample ID | 55343 |
| Solvent | CD3OD |