![3-([O-BETA-D-GLUCOPRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSYL]-OXY)-27-HYDROXY-OLEAN-12-EN-28-OIC-ACID](/api/spectrum/KZGipHf9IfD/structure.png?h=300&w=458 "3-([O-BETA-D-GLUCOPRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSYL]-OXY)-27-HYDROXY-OLEAN-12-EN-28-OIC-ACID")
| SpectraBase Compound ID | 7JujFP5HlsX |
|---|---|
| InChI | InChI=1S/C42H68O14/c1-37(2)13-14-41(36(51)52)15-16-42(20-44)21(22(41)17-37)7-8-26-39(5)11-10-27(38(3,4)25(39)9-12-40(26,42)6)56-35-33(50)31(48)29(46)24(55-35)19-53-34-32(49)30(47)28(45)23(18-43)54-34/h7,22-35,43-50H,8-20H2,1-6H3,(H,51,52)/t22-,23+,24+,25-,26+,27-,28+,29+,30-,31-,32+,33+,34+,35-,39-,40+,41-,42-/m0/s1 |
| InChIKey | DTCDZHUNTIOOHW-WLRQRQRHSA-N |
| Mol Weight | 797.0 g/mol |
| Molecular Formula | C42H68O14 |
| Exact Mass | 796.460907 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KZGipHf9IfD |
|---|---|
| Name | 3-([O-BETA-D-GLUCOPRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSYL]-OXY)-27-HYDROXY-OLEAN-12-EN-28-OIC-ACID |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H68O14 |
| InChI | InChI=1S/C42H68O14/c1-37(2)13-14-41(36(51)52)15-16-42(20-44)21(22(41)17-37)7-8-26-39(5)11-10-27(38(3,4)25(39)9-12-40(26,42)6)56-35-33(50)31(48)29(46)24(55-35)19-53-34-32(49)30(47)28(45)23(18-43)54-34/h7,22-35,43-50H,8-20H2,1-6H3,(H,51,52)/t22-,23+,24+,25-,26+,27-,28+,29+,30-,31-,32+,33+,34+,35-,39-,40+,41-,42-/m0/s1 |
| InChIKey | DTCDZHUNTIOOHW-WLRQRQRHSA-N |
| Literature Reference Author | M.MAILLARD,C.O.ADEWUNMI,K.HOSTETTMANN |
| Literature Reference Citation | PHYTOCHEM.,31,1321(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)80500-E |
| Molecular Weight | 796.994 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN5167 |