![HEMSLOSIDE-MA2;3-O-BETA-[XYLOPYRANOSYL-(1->2)-[ARABINOPYRANOSYL-(1->3)]-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-GLUCOPYRANOSYLESTER](/api/spectrum/5Gewe2QIhrl/structure.png?h=300&w=458 "HEMSLOSIDE-MA2;3-O-BETA-[XYLOPYRANOSYL-(1->2)-[ARABINOPYRANOSYL-(1->3)]-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-GLUCOPYRANOSYLESTER")
| SpectraBase Compound ID | 2T7WDTv7QMk |
|---|---|
| InChI | InChI=1S/C52H82O22/c1-47(2)14-16-52(46(66)74-44-36(62)33(59)32(58)26(19-53)69-44)17-15-50(6)22(23(52)18-47)8-9-28-49(5)12-11-29(48(3,4)27(49)10-13-51(28,50)7)70-45-40(73-43-35(61)31(57)25(55)21-68-43)38(37(63)39(72-45)41(64)65)71-42-34(60)30(56)24(54)20-67-42/h8,23-40,42-45,53-63H,9-21H2,1-7H3,(H,64,65)/t23?,24-,25+,26+,27?,28?,29-,30-,31-,32+,33-,34+,35+,36+,37-,38-,39-,40+,42-,43-,44-,45+,49-,50+,51+,52-/m0/s1 |
| InChIKey | JGWOUOSRJOOXAL-MEHFRGEQSA-N |
| Mol Weight | 1059.2 g/mol |
| Molecular Formula | C52H82O22 |
| Exact Mass | 1058.529774 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5Gewe2QIhrl |
|---|---|
| Name | HEMSLOSIDE-MA2;3-O-BETA-[XYLOPYRANOSYL-(1->2)-[ARABINOPYRANOSYL-(1->3)]-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-GLUCOPYRANOSYLESTER |
| Compound Number | 83 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H82O22 |
| InChI | InChI=1S/C52H82O22/c1-47(2)14-16-52(46(66)74-44-36(62)33(59)32(58)26(19-53)69-44)17-15-50(6)22(23(52)18-47)8-9-28-49(5)12-11-29(48(3,4)27(49)10-13-51(28,50)7)70-45-40(73-43-35(61)31(57)25(55)21-68-43)38(37(63)39(72-45)41(64)65)71-42-34(60)30(56)24(54)20-67-42/h8,23-40,42-45,53-63H,9-21H2,1-7H3,(H,64,65)/t23?,24-,25+,26+,27?,28?,29-,30-,31-,32+,33-,34+,35+,36+,37-,38-,39-,40+,42-,43-,44-,45+,49-,50+,51+,52-/m0/s1 |
| InChIKey | JGWOUOSRJOOXAL-MEHFRGEQSA-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 | 1059.210 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN1247 |