| SpectraBase Compound ID | 7OjHgM9sJCn |
|---|---|
| InChI | InChI=1S/C59H96O28/c1-22-31(64)34(67)39(72)50(79-22)85-44-36(69)33(66)27(19-61)81-52(44)86-45-38(71)37(70)43(48(76)77)84-53(45)82-30-12-13-56(5)28(57(30,6)21-62)11-14-59(8)29(56)10-9-23-24-17-54(2,3)46(75)47(55(24,4)15-16-58(23,59)7)87-49-41(74)42(25(63)20-78-49)83-51-40(73)35(68)32(65)26(18-60)80-51/h9,22,24-47,49-53,60-75H,10-21H2,1-8H3,(H,76,77)/t22-,24-,25+,26-,27+,28+,29+,30-,31-,32-,33-,34+,35+,36-,37-,38-,39+,40-,41-,42+,43-,44+,45+,46-,47+,49+,50-,51+,52-,53+,55+,56-,57+,58+,59+/m0/s1 |
| InChIKey | VITDLFFVKMZRLT-YDTDIKDFSA-N |
| Mol Weight | 1253.4 g/mol |
| Molecular Formula | C59H96O28 |
| Exact Mass | 1252.608812 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4yk19qmHUoo |
|---|---|
| Name | #10;IMPATIENOSIDE-D;22-O-BETA-D-GLUCOPYRANOSYL-(1->3)-ALPHA-L-ARABINOPYRANOSYL-3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GALACTOPYRANOSYL-(1->2)-BETA-D-GLUCURO |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C59H96O28 |
| InChI | InChI=1S/C59H96O28/c1-22-31(64)34(67)39(72)50(79-22)85-44-36(69)33(66)27(19-61)81-52(44)86-45-38(71)37(70)43(48(76)77)84-53(45)82-30-12-13-56(5)28(57(30,6)21-62)11-14-59(8)29(56)10-9-23-24-17-54(2,3)46(75)47(55(24,4)15-16-58(23,59)7)87-49-41(74)42(25(63)20-78-49)83-51-40(73)35(68)32(65)26(18-60)80-51/h9,22,24-47,49-53,60-75H,10-21H2,1-8H3,(H,76,77)/t22-,24-,25+,26-,27+,28+,29+,30-,31-,32-,33-,34+,35+,36-,37-,38-,39+,40-,41-,42+,43-,44+,45+,46-,47+,49+,50-,51+,52-,53+,55+,56-,57+,58+,59+/m0/s1 |
| InChIKey | VITDLFFVKMZRLT-YDTDIKDFSA-N |
| Literature Reference Author | W.LI,X.BI,K.WANG,D.LI,T.SATOU,K.KOIKE |
| Literature Reference Citation | PHYTOCHEM.,70,816(2009) |
| Literature Reference DOI | 10.1016/j.phytochem.2009.03.022 |
| Molecular Weight | 1253.394 g/mol |
| Sample ID | 64706 |
| Solvent | C5D5N |