| SpectraBase Compound ID | 1aqocgHdxX0 |
|---|---|
| InChI | InChI=1S/C34H44O19/c1-14-24(41)26(43)28(45)34(50-14)53-31-29(46)33(47-9-8-16-3-6-18(36)20(38)11-16)51-22(13-49-32-27(44)25(42)21(39)12-48-32)30(31)52-23(40)7-4-15-2-5-17(35)19(37)10-15/h2-7,10-11,14,21-22,24-39,41-46H,8-9,12-13H2,1H3/b7-4+/t14-,21-,22-,24-,25-,26+,27+,28+,29-,30-,31-,32+,33-,34-/m0/s1 |
| InChIKey | XPLMUADTACCMDJ-SNLRNOMDSA-N |
| Mol Weight | 756.7 g/mol |
| Molecular Formula | C34H44O19 |
| Exact Mass | 756.247679 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BIl7Gegc8p |
|---|---|
| Name | ANGOROSIDE-A |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H44O19 |
| InChI | InChI=1S/C34H44O19/c1-14-24(41)26(43)28(45)34(50-14)53-31-29(46)33(47-9-8-16-3-6-18(36)20(38)11-16)51-22(13-49-32-27(44)25(42)21(39)12-48-32)30(31)52-23(40)7-4-15-2-5-17(35)19(37)10-15/h2-7,10-11,14,21-22,24-39,41-46H,8-9,12-13H2,1H3/b7-4+/t14-,21-,22-,24-,25-,26+,27+,28+,29-,30-,31-,32+,33-,34-/m0/s1 |
| InChIKey | XPLMUADTACCMDJ-SNLRNOMDSA-N |
| Literature Reference Author | E.KALPOUTZAKIS,N.ALIGIANNIS,S.MITAKOU,A.L.SKALTSOUNIS |
| Literature Reference Citation | J.NAT.PROD.,62,342(1999) |
| Literature Reference DOI | 10.1021/np980351f |
| Molecular Weight | 756.712 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWCP6180 |