Butanoic acid, 3-methyl-, 1,4a,5,6,7,7a-hexahydro-7-methyl-6-oxo-4-[[(2,3,4,6-tetra-O-acetyl-.beta.-D-glucopyranosyl)oxy]methyl]cyclope nta[c]pyran-1-yl ester, [1S-(1.alpha.,4a.alpha.,7.alpha.,7a.alpha.)]-
Compound with spectra: 1 NMR, and 1 MS (GC)
![Butanoic acid, 3-methyl-, 1,4a,5,6,7,7a-hexahydro-7-methyl-6-oxo-4-[[(2,3,4,6-tetra-O-acetyl-.beta.-D-glucopyranosyl)oxy]methyl]cyclope nta[c]pyran-1-yl ester, [1S-(1.alpha.,4a.alpha.,7.alpha.,7a.alpha.)]-](/api/compound/CzaDbfPVwn0.png?ph=true&h=300&w=458 "Butanoic acid, 3-methyl-, 1,4a,5,6,7,7a-hexahydro-7-methyl-6-oxo-4-[[(2,3,4,6-tetra-O-acetyl-.beta.-D-glucopyranosyl)oxy]methyl]cyclope nta[c]pyran-1-yl ester, [1S-(1.alpha.,4a.alpha.,7.alpha.,7a.alpha.)]-")
| SpectraBase Compound ID | CzaDbfPVwn0 |
|---|---|
| InChI | InChI=1S/C29H40O14/c1-13(2)8-23(35)43-28-24-14(3)21(34)9-20(24)19(10-37-28)11-38-29-27(41-18(7)33)26(40-17(6)32)25(39-16(5)31)22(42-29)12-36-15(4)30/h10,13-14,20,22,24-29H,8-9,11-12H2,1-7H3/t14-,20+,22-,24+,25-,26+,27-,28+,29-/m1/s1 |
| InChIKey | YSPZXXJVXHVWRY-ZEVQKOQDSA-N |
| Mol Weight | 612.6 g/mol |
| Molecular Formula | C29H40O14 |
| Exact Mass | 612.241806 g/mol |
| Enantiomer InChIKey | YSPZXXJVXHVWRY-ZWYGTIPYSA-N |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | H-69-162-2 |
- Ebulosidtetraacetat
- Ebuloside tetraacetate
- (1S,4aR,7S,7aR)-7-methyl-6-oxo-4-{[(2,3,4,6-tetra-O-acetyl-.beta.-D-glucopyranosyl)oxy]methyl}-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl 3-methylbutanoate
- Isovaleriansaure-{1aa.alpha.,5,6,7,7a.alpha.-hexahydro-7.beta.-methyl-6-oxo-4-[(2,3,4,6-tetra-O-acetyl-.beta.-D-glucopyranosyloxy)methyl]cyclopenta[c]pyran-1.beta.-yl}ester
7,8-Dihydro-penstemide pentaacetate
VIBURNALLOSIDE
8a-Adoxoside pentaacetate
WVKGJCUSRQTBMY-TWHLBVFXSA-N
7-OXO-8-KETO-OLEOSIDE-TETRAACETATE-7,11-DIMETHYLESTER
7-ALPHA-ACETOXY-SECOLOGANIC-ACID-PENTAACETATE
2',3',4'-TRI-O-ACETYL-6'-O-([Z]-3-ACETOXY-2-BUTENOYL)-1,5,9-EPIDEOXYLOGANIN
METHYL-ADOXOSIDIC-ACID-11-OATE-2',3',4',6'-TETRAACETATE
FYZORNYQVCKRGZ-YQKSKUOJSA-N
PGOLLLDFXYZNAM-MMAMNPGNSA-N
This compound is available in the following databases:
KnowItAll GC-MS Library
Author: Wiley
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KnowItAll NMR Spectral Library
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Wiley Registry of Mass Spectral Data 2026
Author: Wiley
The foundation library for any analytical laboratory running mass spectrometry, the Wiley Registry provides the broadest coverage available in any mass spectral library Learn more.