| SpectraBase Compound ID | 4dVFNCu2Msc |
|---|---|
| InChI | InChI=1S/C35H54O13/c1-17-31(48-32-30(42)29(41)28(40)25(14-36)47-32)24(38)13-27(45-17)46-20-5-9-34(16-37)19(12-20)3-4-23-22(34)6-8-33(2)21(7-10-35(23,33)43)18-11-26(39)44-15-18/h11,17,19-25,27-32,36-38,40-43H,3-10,12-16H2,1-2H3/t17-,19+,20-,21+,22?,23?,24+,25-,27+,28-,29+,30-,31+,32+,33+,34+,35-/m0/s1 |
| InChIKey | SKYFMHBUKICSBY-YQUOKQFOSA-N |
| Mol Weight | 682.8 g/mol |
| Molecular Formula | C35H54O13 |
| Exact Mass | 682.356442 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Jd9zbhijZyR |
|---|---|
| Name | CANNOGENOL-3-O-BETA-D-GLUCOPYRANOSYL-(1->4)-O-BETA-D-BOIVINOPYRANOSIDE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H54O13 |
| InChI | InChI=1S/C35H54O13/c1-17-31(48-32-30(42)29(41)28(40)25(14-36)47-32)24(38)13-27(45-17)46-20-5-9-34(16-37)19(12-20)3-4-23-22(34)6-8-33(2)21(7-10-35(23,33)43)18-11-26(39)44-15-18/h11,17,19-25,27-32,36-38,40-43H,3-10,12-16H2,1-2H3/t17-,19+,20-,21+,22?,23?,24+,25-,27+,28-,29+,30-,31+,32+,33+,34+,35-/m0/s1 |
| InChIKey | SKYFMHBUKICSBY-YQUOKQFOSA-N |
| Literature Reference Author | T.NAKAMURA,Y.GODA,S.SAKAI,K.KONDO,H.AKIYAMA,M.TOYODA |
| Literature Reference Citation | PHYTOCHEM.,49,2097(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00421-X |
| Molecular Weight | 682.806 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU888 |