![#8B;3-BETA-[BETA-D-GLUCOPYRANOSYL-(1->2)]-[BETA-D-XYLOPYRANOSYL-(1->3)]-BETA-D-GLUCURONOPYRANOSYLOXY-OLEAN-12-ENE-15-ALPHA,16-ALPHA,21-BETA,22-ALPHA,28-PENTANO](/api/spectrum/7POV2kpWQsi/structure.png?h=300&w=458 "#8B;3-BETA-[BETA-D-GLUCOPYRANOSYL-(1->2)]-[BETA-D-XYLOPYRANOSYL-(1->3)]-BETA-D-GLUCURONOPYRANOSYLOXY-OLEAN-12-ENE-15-ALPHA,16-ALPHA,21-BETA,22-ALPHA,28-PENTANO")
| SpectraBase Compound ID | ARWjLaeORTv |
|---|---|
| InChI | InChI=1S/C47H76O21/c1-42(2)14-19-18-8-9-23-44(5)12-11-24(43(3,4)22(44)10-13-45(23,6)46(18,7)35(58)37(60)47(19,17-49)36(59)34(42)57)65-41-33(68-40-29(55)27(53)26(52)21(15-48)64-40)31(30(56)32(67-41)38(61)62)66-39-28(54)25(51)20(50)16-63-39/h8,19-37,39-41,48-60H,9-17H2,1-7H3,(H,61,62)/t19-,20+,21-,22-,23+,24-,25-,26-,27+,28+,29-,30-,31-,32-,33+,34-,35-,36-,37+,39-,40+,41+,44-,45+,46-,47+/m0/s1 |
| InChIKey | NMNQNFOVYHFZLE-RHXMTOGFSA-N |
| Mol Weight | 977.1 g/mol |
| Molecular Formula | C47H76O21 |
| Exact Mass | 976.487909 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7POV2kpWQsi |
|---|---|
| Name | #8B;3-BETA-[BETA-D-GLUCOPYRANOSYL-(1->2)]-[BETA-D-XYLOPYRANOSYL-(1->3)]-BETA-D-GLUCURONOPYRANOSYLOXY-OLEAN-12-ENE-15-ALPHA,16-ALPHA,21-BETA,22-ALPHA,28-PENTANO |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H76O21 |
| InChI | InChI=1S/C47H76O21/c1-42(2)14-19-18-8-9-23-44(5)12-11-24(43(3,4)22(44)10-13-45(23,6)46(18,7)35(58)37(60)47(19,17-49)36(59)34(42)57)65-41-33(68-40-29(55)27(53)26(52)21(15-48)64-40)31(30(56)32(67-41)38(61)62)66-39-28(54)25(51)20(50)16-63-39/h8,19-37,39-41,48-60H,9-17H2,1-7H3,(H,61,62)/t19-,20+,21-,22-,23+,24-,25-,26-,27+,28+,29-,30-,31-,32-,33+,34-,35-,36-,37+,39-,40+,41+,44-,45+,46-,47+/m0/s1 |
| InChIKey | NMNQNFOVYHFZLE-RHXMTOGFSA-N |
| Literature Reference Author | Z.ZHANG,S.LI,S.OWNBY,P.WANG,W.YUAN,W.ZHANG,R.S.BEASLEY |
| Literature Reference Citation | PHYTOCHEM.,69,2070(2008) |
| Literature Reference DOI | 10.1016/j.phytochem.2008.03.020 |
| Molecular Weight | 977.108 g/mol |
| Sample ID | 63223 |
| Solvent | C5D5N |