![HEMSLOSIDE-G2;3-O-BETA-[GLUCOPYRANOSYL-(1->2)-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-[GLUCOPYRANOSYL-(1->6)-GLUCOPYRANOSYL]-ESTER](/api/spectrum/EGNGpQ4Gakt/structure.png?h=300&w=458 "HEMSLOSIDE-G2;3-O-BETA-[GLUCOPYRANOSYL-(1->2)-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-[GLUCOPYRANOSYL-(1->6)-GLUCOPYRANOSYL]-ESTER")
| SpectraBase Compound ID | Hoz5MymfOVv |
|---|---|
| InChI | InChI=1S/C54H86O24/c1-49(2)14-16-54(48(70)78-46-40(67)35(62)32(59)26(74-46)21-71-44-38(65)33(60)30(57)24(19-55)72-44)17-15-52(6)22(23(54)18-49)8-9-28-51(5)12-11-29(50(3,4)27(51)10-13-53(28,52)7)75-47-42(37(64)36(63)41(76-47)43(68)69)77-45-39(66)34(61)31(58)25(20-56)73-45/h8,23-42,44-47,55-67H,9-21H2,1-7H3,(H,68,69)/t23?,24-,25-,26-,27?,28?,29+,30-,31-,32-,33+,34+,35+,36+,37+,38-,39-,40-,41+,42-,44-,45+,46+,47-,51+,52-,53-,54+/m1/s1 |
| InChIKey | SCGZGMGJBYDJHK-JIWUHWEISA-N |
| Mol Weight | 1119.3 g/mol |
| Molecular Formula | C54H86O24 |
| Exact Mass | 1118.550904 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EGNGpQ4Gakt |
|---|---|
| Name | HEMSLOSIDE-G2;3-O-BETA-[GLUCOPYRANOSYL-(1->2)-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-[GLUCOPYRANOSYL-(1->6)-GLUCOPYRANOSYL]-ESTER |
| Compound Number | 81 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C54H86O24 |
| InChI | InChI=1S/C54H86O24/c1-49(2)14-16-54(48(70)78-46-40(67)35(62)32(59)26(74-46)21-71-44-38(65)33(60)30(57)24(19-55)72-44)17-15-52(6)22(23(54)18-49)8-9-28-51(5)12-11-29(50(3,4)27(51)10-13-53(28,52)7)75-47-42(37(64)36(63)41(76-47)43(68)69)77-45-39(66)34(61)31(58)25(20-56)73-45/h8,23-42,44-47,55-67H,9-21H2,1-7H3,(H,68,69)/t23?,24-,25-,26-,27?,28?,29+,30-,31-,32-,33+,34+,35+,36+,37+,38-,39-,40-,41+,42-,44-,45+,46+,47-,51+,52-,53-,54+/m1/s1 |
| InChIKey | SCGZGMGJBYDJHK-JIWUHWEISA-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 | 1119.262 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN1245 |