![PSEUDOSTELLARINOSIDE-A;3-O-BETA-[GLUCOPYRANOSYL-(1->3)-[GLUCOPYRANOSYL-(1->4)]-GLUCURONOPYRANOSYL]-GYPSOGENIN-28-O-GLUCOPYRANOSYLESTER](/api/spectrum/DgitLmSlrtV/structure.png?h=300&w=458 "PSEUDOSTELLARINOSIDE-A;3-O-BETA-[GLUCOPYRANOSYL-(1->3)-[GLUCOPYRANOSYL-(1->4)]-GLUCURONOPYRANOSYL]-GYPSOGENIN-28-O-GLUCOPYRANOSYLESTER")
| SpectraBase Compound ID | DQWyWoQxT7s |
|---|---|
| InChI | InChI=1S/C54H84O25/c1-49(2)13-15-54(48(71)79-46-38(67)35(64)32(61)26(20-57)74-46)16-14-52(5)22(23(54)17-49)7-8-28-50(3)11-10-29(51(4,21-58)27(50)9-12-53(28,52)6)75-47-39(68)40(76-44-36(65)33(62)30(59)24(18-55)72-44)41(42(78-47)43(69)70)77-45-37(66)34(63)31(60)25(19-56)73-45/h7,21,23-42,44-47,55-57,59-68H,8-20H2,1-6H3,(H,69,70)/t23?,24-,25+,26+,27?,28?,29-,30-,31+,32+,33+,34-,35-,36-,37+,38+,39+,40+,41-,42-,44+,45-,46-,47+,50-,51-,52+,53+,54-/m0/s1 |
| InChIKey | XIJYMRWYWWCVNF-OIMBHZGMSA-N |
| Mol Weight | 1133.2 g/mol |
| Molecular Formula | C54H84O25 |
| Exact Mass | 1132.530168 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DgitLmSlrtV |
|---|---|
| Name | PSEUDOSTELLARINOSIDE-A;3-O-BETA-[GLUCOPYRANOSYL-(1->3)-[GLUCOPYRANOSYL-(1->4)]-GLUCURONOPYRANOSYL]-GYPSOGENIN-28-O-GLUCOPYRANOSYLESTER |
| Compound Number | 134 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C54H84O25 |
| InChI | InChI=1S/C54H84O25/c1-49(2)13-15-54(48(71)79-46-38(67)35(64)32(61)26(20-57)74-46)16-14-52(5)22(23(54)17-49)7-8-28-50(3)11-10-29(51(4,21-58)27(50)9-12-53(28,52)6)75-47-39(68)40(76-44-36(65)33(62)30(59)24(18-55)72-44)41(42(78-47)43(69)70)77-45-37(66)34(63)31(60)25(19-56)73-45/h7,21,23-42,44-47,55-57,59-68H,8-20H2,1-6H3,(H,69,70)/t23?,24-,25+,26+,27?,28?,29-,30-,31+,32+,33+,34-,35-,36-,37+,38+,39+,40+,41-,42-,44+,45-,46-,47+,50-,51-,52+,53+,54-/m0/s1 |
| InChIKey | XIJYMRWYWWCVNF-OIMBHZGMSA-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 | 1133.246 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN1124 |