| SpectraBase Compound ID | HDdbFPrXOwO |
|---|---|
| InChI | InChI=1S/C31H58O13/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-39-29-27(37)24(34)21(18-41-29)44-31-28(38)25(35)22(19-42-31)43-30-26(36)23(33)20(32)17-40-30/h20-38H,2-19H2,1H3/t20-,21-,22-,23-,24-,25-,26+,27+,28+,29-,30+,31+/m1/s1 |
| InChIKey | OPUJZSSPKOMRFY-YMISPKBISA-N |
| Mol Weight | 638.8 g/mol |
| Molecular Formula | C31H58O13 |
| Exact Mass | 638.387742 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CdRroBCbaLL |
|---|---|
| Name | FIRMACOSIDE-A;HEXADECANYL-1-O-ALPHA-D-ARABINOPYRANOSYLOXY-(1->4)-ALPHA-D-ARABINOPYRANOSYLOXY-(1->4)-ALPHA-D-ARABINOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H58O13 |
| InChI | InChI=1S/C31H58O13/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-39-29-27(37)24(34)21(18-41-29)44-31-28(38)25(35)22(19-42-31)43-30-26(36)23(33)20(32)17-40-30/h20-38H,2-19H2,1H3/t20-,21-,22-,23-,24-,25-,26+,27+,28+,29-,30+,31+/m1/s1 |
| InChIKey | OPUJZSSPKOMRFY-YMISPKBISA-N |
| Literature Reference Author | R.KUMAR,V.LAKSHMI |
| Literature Reference Citation | CHEM.PHARM.BULL.,54,1650(2006) |
| Literature Reference DOI | 10.1248/cpb.54.1650 |
| Molecular Weight | 638.794 g/mol |
| Sample ID | 55320 |
| Solvent | C5D5N |