![3-O-BETA-[GLUCOPYRANOSYL-(1->2)-XYLOPYRANOSYL-(1->3)-[GLUCOPYRANOSYL-(1->2)]-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-GLUCOPYRANOSYLESTER](/api/spectrum/GvvTkz9ylub/structure.png?h=300&w=458 "3-O-BETA-[GLUCOPYRANOSYL-(1->2)-XYLOPYRANOSYL-(1->3)-[GLUCOPYRANOSYL-(1->2)]-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-GLUCOPYRANOSYLESTER")
| SpectraBase Compound ID | Inhq1qyXDQa |
|---|---|
| InChI | InChI=1S/C59H94O28/c1-54(2)14-16-59(53(77)87-50-41(73)38(70)35(67)28(21-62)81-50)17-15-57(6)23(24(59)18-54)8-9-30-56(5)12-11-31(55(3,4)29(56)10-13-58(30,57)7)82-52-46(86-49-40(72)37(69)34(66)27(20-61)80-49)43(42(74)44(84-52)47(75)76)83-51-45(32(64)25(63)22-78-51)85-48-39(71)36(68)33(65)26(19-60)79-48/h8,24-46,48-52,60-74H,9-22H2,1-7H3,(H,75,76)/t24?,25-,26-,27+,28-,29?,30?,31+,32+,33-,34+,35-,36+,37-,38+,39-,40+,41-,42+,43+,44+,45-,46-,48+,49-,50+,51+,52-,56+,57-,58-,59+/m1/s1 |
| InChIKey | HZBHCPVDRDPDEC-HOLCMAMKSA-N |
| Mol Weight | 1251.4 g/mol |
| Molecular Formula | C59H94O28 |
| Exact Mass | 1250.593162 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GvvTkz9ylub |
|---|---|
| Name | 3-O-BETA-[GLUCOPYRANOSYL-(1->2)-XYLOPYRANOSYL-(1->3)-[GLUCOPYRANOSYL-(1->2)]-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-GLUCOPYRANOSYLESTER |
| Compound Number | 130 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C59H94O28 |
| InChI | InChI=1S/C59H94O28/c1-54(2)14-16-59(53(77)87-50-41(73)38(70)35(67)28(21-62)81-50)17-15-57(6)23(24(59)18-54)8-9-30-56(5)12-11-31(55(3,4)29(56)10-13-58(30,57)7)82-52-46(86-49-40(72)37(69)34(66)27(20-61)80-49)43(42(74)44(84-52)47(75)76)83-51-45(32(64)25(63)22-78-51)85-48-39(71)36(68)33(65)26(19-60)79-48/h8,24-46,48-52,60-74H,9-22H2,1-7H3,(H,75,76)/t24?,25-,26-,27+,28-,29?,30?,31+,32+,33-,34+,35-,36+,37-,38+,39-,40+,41-,42+,43+,44+,45-,46-,48+,49-,50+,51+,52-,56+,57-,58-,59+/m1/s1 |
| InChIKey | HZBHCPVDRDPDEC-HOLCMAMKSA-N |
| Literature Reference Author | N.TAN,J.ZHOU,S.ZHAO |
| Literature Reference Citation | PHYTOCHEM.,52,153(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00454-3 |
| Molecular Weight | 1251.379 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN1259 |