![INDIOSIDE_I;3-O-{ALPHA-L-RHAMNOPYRANOSIDE-(1->2)-O-[ALPHA-L-RHAMNOPYRANOSIDE-(1->4)]-BETA-D-GLUCOPYRANOSYL}-(22-R,25-S)-](/api/spectrum/FgBeYfdt4gj/structure.png?h=300&w=458 "INDIOSIDE_I;3-O-{ALPHA-L-RHAMNOPYRANOSIDE-(1->2)-O-[ALPHA-L-RHAMNOPYRANOSIDE-(1->4)]-BETA-D-GLUCOPYRANOSYL}-(22-R,25-S)-")
| SpectraBase Compound ID | 23DGVc0y1px |
|---|---|
| InChI | InChI=1S/C45H74O16/c1-19-9-14-45(54-18-19)20(2)30-28(61-45)16-27-25-8-7-23-15-24(10-12-43(23,5)26(25)11-13-44(27,30)6)57-42-39(60-41-36(52)34(50)32(48)22(4)56-41)37(53)38(29(17-46)58-42)59-40-35(51)33(49)31(47)21(3)55-40/h19-42,46-53H,7-18H2,1-6H3/t19-,20+,21-,22-,23-,24-,25+,26-,27-,28-,29+,30-,31-,32-,33+,34+,35+,36+,37-,38+,39+,40-,41-,42+,43-,44-,45+/m0/s1 |
| InChIKey | KFYOFJUUTSALEH-VJGWCNBMSA-N |
| Mol Weight | 871.1 g/mol |
| Molecular Formula | C45H74O16 |
| Exact Mass | 870.497686 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FgBeYfdt4gj |
|---|---|
| Name | INDIOSIDE_I;3-O-{ALPHA-L-RHAMNOPYRANOSIDE-(1->2)-O-[ALPHA-L-RHAMNOPYRANOSIDE-(1->4)]-BETA-D-GLUCOPYRANOSYL}-(22-R,25-S)- |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H74O16 |
| InChI | InChI=1S/C45H74O16/c1-19-9-14-45(54-18-19)20(2)30-28(61-45)16-27-25-8-7-23-15-24(10-12-43(23,5)26(25)11-13-44(27,30)6)57-42-39(60-41-36(52)34(50)32(48)22(4)56-41)37(53)38(29(17-46)58-42)59-40-35(51)33(49)31(47)21(3)55-40/h19-42,46-53H,7-18H2,1-6H3/t19-,20+,21-,22-,23-,24-,25+,26-,27-,28-,29+,30-,31-,32-,33+,34+,35+,36+,37-,38+,39+,40-,41-,42+,43-,44-,45+/m0/s1 |
| InChIKey | KFYOFJUUTSALEH-VJGWCNBMSA-N |
| Literature Reference Author | C.T.YEN,C.L.LEE,F.R.CHANG,T.L.HWANG,H.F.YEN,C.J.CHEN,S.L.CHE N,Y.C.WU |
| Literature Reference Citation | J.NAT.PROD.,75,636(2012) |
| Literature Reference DOI | 10.1021/np200877u |
| Molecular Weight | 871.073 g/mol |
| Sample ID | 40258 |
| Solvent | C5D5N |