![3-O-BETA-[RHAMNOPYRANOSYL-(1->3)-GLUCURONOPYRANOSYL]-HEDERAGENIN](/api/spectrum/LZZG00Javiu/structure.png?h=300&w=458 "3-O-BETA-[RHAMNOPYRANOSYL-(1->3)-GLUCURONOPYRANOSYL]-HEDERAGENIN")
| SpectraBase Compound ID | CJ4DgeMmi43 |
|---|---|
| InChI | InChI=1S/C42H66O14/c1-20-26(44)27(45)28(46)34(53-20)55-31-29(47)32(33(49)50)56-35(30(31)48)54-25-11-12-38(4)23(39(25,5)19-43)10-13-41(7)24(38)9-8-21-22-18-37(2,3)14-16-42(22,36(51)52)17-15-40(21,41)6/h8,20,22-32,34-35,43-48H,9-19H2,1-7H3,(H,49,50)(H,51,52)/t20-,22?,23?,24?,25-,26-,27+,28+,29-,30+,31-,32-,34-,35+,38-,39-,40+,41+,42-/m0/s1 |
| InChIKey | WABIGKXMKDEKAW-RKGFMRDTSA-N |
| Mol Weight | 795.0 g/mol |
| Molecular Formula | C42H66O14 |
| Exact Mass | 794.445257 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LZZG00Javiu |
|---|---|
| Name | 3-O-BETA-[RHAMNOPYRANOSYL-(1->3)-GLUCURONOPYRANOSYL]-HEDERAGENIN |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H66O14 |
| InChI | InChI=1S/C42H66O14/c1-20-26(44)27(45)28(46)34(53-20)55-31-29(47)32(33(49)50)56-35(30(31)48)54-25-11-12-38(4)23(39(25,5)19-43)10-13-41(7)24(38)9-8-21-22-18-37(2,3)14-16-42(22,36(51)52)17-15-40(21,41)6/h8,20,22-32,34-35,43-48H,9-19H2,1-7H3,(H,49,50)(H,51,52)/t20-,22?,23?,24?,25-,26-,27+,28+,29-,30+,31-,32-,34-,35+,38-,39-,40+,41+,42-/m0/s1 |
| InChIKey | WABIGKXMKDEKAW-RKGFMRDTSA-N |
| Literature Reference Author | N.TAN,J.ZHOU,S.ZHAO |
| Literature Reference Citation | PHYTOCHEM.,52,153(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00454-3 |
| Molecular Weight | 794.978 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN1133 |