![3-BETA,16-BETA,23-TRIHYDROXY-13,28-EPOXYOLEAN-11-EN-3-BETA-YL-[BETA-D-GLUCOPYRANOSYL-(1->2)]-[BETA-D-GLUCOPYRANOSYL-(1->3)]-BETA-D-FUCOPYRANOSIDE](/api/spectrum/EJHSZ5MRZQn/structure.png?h=300&w=458 "3-BETA,16-BETA,23-TRIHYDROXY-13,28-EPOXYOLEAN-11-EN-3-BETA-YL-[BETA-D-GLUCOPYRANOSYL-(1->2)]-[BETA-D-GLUCOPYRANOSYL-(1->3)]-BETA-D-FUCOPYRANOSIDE")
| SpectraBase Compound ID | B0g3V9QwqNW |
|---|---|
| InChI | InChI=1S/C48H78O18/c1-22-30(53)37(65-39-35(58)33(56)31(54)23(18-49)62-39)38(66-40-36(59)34(57)32(55)24(19-50)63-40)41(61-22)64-29-10-11-43(4)25(44(29,5)20-51)8-12-45(6)26(43)9-13-48-27-16-42(2,3)14-15-47(27,21-60-48)28(52)17-46(45,48)7/h9,13,22-41,49-59H,8,10-12,14-21H2,1-7H3/t22-,23-,24+,25?,26?,27?,28-,29-,30+,31-,32+,33+,34-,35-,36+,37+,38-,39+,40-,41+,43-,44-,45+,46-,47+,48-/m0/s1 |
| InChIKey | IRJDRINEGANBIK-WOHOHQMTSA-N |
| Mol Weight | 943.1 g/mol |
| Molecular Formula | C48H78O18 |
| Exact Mass | 942.518816 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EJHSZ5MRZQn |
|---|---|
| Name | 3-BETA,16-BETA,23-TRIHYDROXY-13,28-EPOXYOLEAN-11-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 | C48H78O18 |
| InChI | InChI=1S/C48H78O18/c1-22-30(53)37(65-39-35(58)33(56)31(54)23(18-49)62-39)38(66-40-36(59)34(57)32(55)24(19-50)63-40)41(61-22)64-29-10-11-43(4)25(44(29,5)20-51)8-12-45(6)26(43)9-13-48-27-16-42(2,3)14-15-47(27,21-60-48)28(52)17-46(45,48)7/h9,13,22-41,49-59H,8,10-12,14-21H2,1-7H3/t22-,23-,24+,25?,26?,27?,28-,29-,30+,31-,32+,33+,34-,35-,36+,37+,38-,39+,40-,41+,43-,44-,45+,46-,47+,48-/m0/s1 |
| InChIKey | IRJDRINEGANBIK-WOHOHQMTSA-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 | 943.137 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWTS1066 |