![16-ALPHA,23,28-TRIHYDROXY-11-ALPHA-METHOXYOLEAN-12-EN-3-BETA-YL-[BETA-D-GLUCOPYRANOSYL-(1->2)]-[BETA-D-GLUCOPYRANOSYL-(1->3)]-BETA-D-FUCOPYRANOSIDE](/api/spectrum/9vzVG3GKOWa/structure.png?h=300&w=458 "16-ALPHA,23,28-TRIHYDROXY-11-ALPHA-METHOXYOLEAN-12-EN-3-BETA-YL-[BETA-D-GLUCOPYRANOSYL-(1->2)]-[BETA-D-GLUCOPYRANOSYL-(1->3)]-BETA-D-FUCOPYRANOSIDE")
| SpectraBase Compound ID | K3v6cY1CpDL |
|---|---|
| InChI | InChI=1S/C49H82O19/c1-22-31(55)38(67-41-36(60)34(58)32(56)26(18-50)64-41)39(68-42-37(61)35(59)33(57)27(19-51)65-42)43(63-22)66-30-10-11-45(4)28(46(30,5)20-52)9-12-47(6)40(45)25(62-8)15-23-24-16-44(2,3)13-14-49(24,21-53)29(54)17-48(23,47)7/h15,22,24-43,50-61H,9-14,16-21H2,1-8H3/t22-,24?,25+,26-,27+,28?,29-,30-,31+,32-,33+,34+,35-,36-,37+,38+,39-,40?,41+,42-,43+,45-,46-,47+,48+,49+/m0/s1 |
| InChIKey | OZPOGANASPSVJC-KMSVBWINSA-N |
| Mol Weight | 975.2 g/mol |
| Molecular Formula | C49H82O19 |
| Exact Mass | 974.54503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9vzVG3GKOWa |
|---|---|
| Name | 16-ALPHA,23,28-TRIHYDROXY-11-ALPHA-METHOXYOLEAN-12-EN-3-BETA-YL-[BETA-D-GLUCOPYRANOSYL-(1->2)]-[BETA-D-GLUCOPYRANOSYL-(1->3)]-BETA-D-FUCOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H82O19 |
| InChI | InChI=1S/C49H82O19/c1-22-31(55)38(67-41-36(60)34(58)32(56)26(18-50)64-41)39(68-42-37(61)35(59)33(57)27(19-51)65-42)43(63-22)66-30-10-11-45(4)28(46(30,5)20-52)9-12-47(6)40(45)25(62-8)15-23-24-16-44(2,3)13-14-49(24,21-53)29(54)17-48(23,47)7/h15,22,24-43,50-61H,9-14,16-21H2,1-8H3/t22-,24?,25+,26-,27+,28?,29-,30-,31+,32-,33+,34+,35-,36-,37+,38+,39-,40?,41+,42-,43+,45-,46-,47+,48+,49+/m0/s1 |
| InChIKey | OZPOGANASPSVJC-KMSVBWINSA-N |
| Literature Reference Author | L.PISTELLI,A.R.BILIA,A.MARSILI,N.DETOMMASI,A.MANUNTA |
| Literature Reference Citation | J.NAT.PROD.,56,240(1993) |
| Literature Reference DOI | 10.1021/np50092a009 |
| Molecular Weight | 975.179 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWTS1067 |