![(23S,25R)-SPIROST-5-EN-3-BETA,23-DIOL-3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[BETA-D-XYLOPARANOSYL-(1->3)]-BETA-D-GLUCOPYRANOSIDE]](/api/spectrum/JKSUCef23Ex/structure.png?h=300&w=458 "(23S,25R)-SPIROST-5-EN-3-BETA,23-DIOL-3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[BETA-D-XYLOPARANOSYL-(1->3)]-BETA-D-GLUCOPYRANOSIDE]")
| SpectraBase Compound ID | KbDRQTgwrXo |
|---|---|
| InChI | InChI=1S/C44H70O17/c1-18-12-29(47)44(55-16-18)19(2)30-27(61-44)14-25-23-7-6-21-13-22(8-10-42(21,4)24(23)9-11-43(25,30)5)57-41-38(60-40-36(53)34(51)31(48)20(3)56-40)37(33(50)28(15-45)58-41)59-39-35(52)32(49)26(46)17-54-39/h6,18-20,22-41,45-53H,7-17H2,1-5H3/t18-,19+,20-,22+,23-,24+,25+,26-,27+,28-,29+,30+,31-,32+,33-,34+,35-,36+,37+,38-,39+,40-,41-,42+,43+,44+/m1/s1 |
| InChIKey | KCMFECTXPMHXFE-RURQMXKMSA-N |
| Mol Weight | 871.0 g/mol |
| Molecular Formula | C44H70O17 |
| Exact Mass | 870.461301 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JKSUCef23Ex |
|---|---|
| Name | (23S,25R)-SPIROST-5-EN-3-BETA,23-DIOL-3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[BETA-D-XYLOPARANOSYL-(1->3)]-BETA-D-GLUCOPYRANOSIDE] |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H70O17 |
| InChI | InChI=1S/C44H70O17/c1-18-12-29(47)44(55-16-18)19(2)30-27(61-44)14-25-23-7-6-21-13-22(8-10-42(21,4)24(23)9-11-43(25,30)5)57-41-38(60-40-36(53)34(51)31(48)20(3)56-40)37(33(50)28(15-45)58-41)59-39-35(52)32(49)26(46)17-54-39/h6,18-20,22-41,45-53H,7-17H2,1-5H3/t18-,19+,20-,22+,23-,24+,25+,26-,27+,28-,29+,30+,31-,32+,33-,34+,35-,36+,37+,38-,39+,40-,41-,42+,43+,44+/m1/s1 |
| InChIKey | KCMFECTXPMHXFE-RURQMXKMSA-N |
| Literature Reference Author | S.YAHARA,T.NALAMURA,Y.SOMEYA,T.MATSUMOTO,T.YAMASHITA,T.NOHAR A |
| Literature Reference Citation | PHYTOCHEM.,43,1319(1996) |
| Literature Reference DOI | 10.1016/S0031-9422(96)00395-0 |
| Molecular Weight | 871.030 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS2411 |