![ISOHUMBERTIOL-3-O-(ALPHA-L-RHAMNOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[ALPHA-L-RHAMNOPYRANOSYL-(1->6)])-BETA-D-GLUCOPYRANOSIDE](/api/spectrum/DEcY5po29bN/structure.png?h=300&w=458 "ISOHUMBERTIOL-3-O-(ALPHA-L-RHAMNOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[ALPHA-L-RHAMNOPYRANOSYL-(1->6)])-BETA-D-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | KtuvEVfz1wf |
|---|---|
| InChI | InChI=1S/C39H64O18/c1-9-39(8,13-20-12-16(4)10-11-21(20)15(2)3)57-38-34(28(45)25(42)22(54-38)14-50-35-30(47)26(43)23(40)17(5)51-35)56-37-32(49)29(46)33(19(7)53-37)55-36-31(48)27(44)24(41)18(6)52-36/h9,12,17-20,22-38,40-49H,1,10-11,13-14H2,2-8H3/t17-,18-,19+,20?,22-,23-,24-,25-,26+,27+,28+,29+,30-,31-,32+,33+,34-,35-,36+,37-,38+,39?/m1/s1 |
| InChIKey | YLJYLCXCRLFRHF-ADHZWSRCSA-N |
| Mol Weight | 820.9 g/mol |
| Molecular Formula | C39H64O18 |
| Exact Mass | 820.409265 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DEcY5po29bN |
|---|---|
| Name | ISOHUMBERTIOL-3-O-(ALPHA-L-RHAMNOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[ALPHA-L-RHAMNOPYRANOSYL-(1->6)])-BETA-D-GLUCOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H64O18 |
| InChI | InChI=1S/C39H64O18/c1-9-39(8,13-20-12-16(4)10-11-21(20)15(2)3)57-38-34(28(45)25(42)22(54-38)14-50-35-30(47)26(43)23(40)17(5)51-35)56-37-32(49)29(46)33(19(7)53-37)55-36-31(48)27(44)24(41)18(6)52-36/h9,12,17-20,22-38,40-49H,1,10-11,13-14H2,2-8H3/t17-,18-,19+,20?,22-,23-,24-,25-,26+,27+,28+,29+,30-,31-,32+,33+,34-,35-,36+,37-,38+,39?/m1/s1 |
| InChIKey | YLJYLCXCRLFRHF-ADHZWSRCSA-N |
| Literature Reference Author | N.DETOMMASI,R.AQUINO,F.DESIMONE,C.PIZZA |
| Literature Reference Citation | J.NAT.PROD.,55,1025(1992) |
| Literature Reference DOI | 10.1021/np50086a001 |
| Molecular Weight | 820.926 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWCS5316 |