| SpectraBase Compound ID | KOUrCaCRiBC |
|---|---|
| InChI | InChI=1S/C39H62O14/c1-17-7-10-39(48-16-17)18(2)28-25(53-39)12-22-20-6-5-19-11-24(23(42)13-38(19,4)21(20)8-9-37(22,28)3)49-36-34(32(46)30(44)27(15-41)51-36)52-35-33(47)31(45)29(43)26(14-40)50-35/h18-36,40-47H,1,5-16H2,2-4H3/t18-,19+,20+,21-,22-,23-,24+,25-,26-,27-,28-,29-,30+,31+,32+,33-,34-,35+,36-,37-,38-,39+/m0/s1 |
| InChIKey | AQYRNJPPAIKAIO-PZOLBBGZSA-N |
| Mol Weight | 754.9 g/mol |
| Molecular Formula | C39H62O14 |
| Exact Mass | 754.413957 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7B8EB9BoGon |
|---|---|
| Name | SPIROST-25(27)-ENE-2-BETA,3-BETA-DIOL-3-O-BETA-D-GALACTOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H62O14 |
| InChI | InChI=1S/C39H62O14/c1-17-7-10-39(48-16-17)18(2)28-25(53-39)12-22-20-6-5-19-11-24(23(42)13-38(19,4)21(20)8-9-37(22,28)3)49-36-34(32(46)30(44)27(15-41)51-36)52-35-33(47)31(45)29(43)26(14-40)50-35/h18-36,40-47H,1,5-16H2,2-4H3/t18-,19+,20+,21-,22-,23-,24+,25-,26-,27-,28-,29-,30+,31+,32+,33-,34-,35+,36-,37-,38-,39+/m0/s1 |
| InChIKey | AQYRNJPPAIKAIO-PZOLBBGZSA-N |
| Literature Reference Author | X.HE,F.QIU,Y.SHOYAMA,H.TANAKA,X.YAO |
| Literature Reference Citation | CHEM.PHARM.BULL.,50,653(2002) |
| Literature Reference DOI | 10.1248/cpb.50.653 |
| Molecular Weight | 754.913 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN8164 |