![GUAIACIN-D;#2;3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL-(3->1)-BETA-D-GLUCOPYRANOSYL]-30-NOROLEAN-12,20(29)-DIEN-28-O-[BETA-D-GLUCOPYRANOSYL](/api/spectrum/91pVSxyqG1M/structure.png?h=300&w=458 "GUAIACIN-D;#2;3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL-(3->1)-BETA-D-GLUCOPYRANOSYL]-30-NOROLEAN-12,20(29)-DIEN-28-O-[BETA-D-GLUCOPYRANOSYL")
| SpectraBase Compound ID | 5Ui91vpXwCn |
|---|---|
| InChI | InChI=1S/C52H82O21/c1-22-10-15-52(47(65)73-45-40(64)37(61)34(58)28(20-54)69-45)17-16-50(6)24(25(52)18-22)8-9-30-49(5)13-12-31(48(3,4)29(49)11-14-51(30,50)7)70-46-42(72-43-38(62)35(59)32(56)23(2)67-43)41(26(55)21-66-46)71-44-39(63)36(60)33(57)27(19-53)68-44/h8,23,25-46,53-64H,1,9-21H2,2-7H3/t23-,25-,26+,27-,28+,29-,30+,31-,32-,33-,34+,35+,36+,37-,38+,39-,40+,41+,42-,43-,44+,45-,46+,49-,50+,51+,52-/m0/s1 |
| InChIKey | IFKVQLFRSXXGJD-ZDZNLANWSA-N |
| Mol Weight | 1043.2 g/mol |
| Molecular Formula | C52H82O21 |
| Exact Mass | 1042.53486 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 91pVSxyqG1M |
|---|---|
| Name | GUAIACIN-D;#2;3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL-(3->1)-BETA-D-GLUCOPYRANOSYL]-30-NOROLEAN-12,20(29)-DIEN-28-O-[BETA-D-GLUCOPYRANOSYL |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H82O21 |
| InChI | InChI=1S/C52H82O21/c1-22-10-15-52(47(65)73-45-40(64)37(61)34(58)28(20-54)69-45)17-16-50(6)24(25(52)18-22)8-9-30-49(5)13-12-31(48(3,4)29(49)11-14-51(30,50)7)70-46-42(72-43-38(62)35(59)32(56)23(2)67-43)41(26(55)21-66-46)71-44-39(63)36(60)33(57)27(19-53)68-44/h8,23,25-46,53-64H,1,9-21H2,2-7H3/t23-,25-,26+,27-,28+,29-,30+,31-,32-,33-,34+,35+,36+,37-,38+,39-,40+,41+,42-,43-,44+,45-,46+,49-,50+,51+,52-/m0/s1 |
| InChIKey | IFKVQLFRSXXGJD-ZDZNLANWSA-N |
| Literature Reference Author | V.U.AHMAD,S.PERVEEN,S.BANO |
| Literature Reference Citation | PHYTOCHEM.,29,3287(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)80201-Q |
| Molecular Weight | 1043.210 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWKP6811 |