| SpectraBase Compound ID | 5jasrEqB8TP |
|---|---|
| InChI | InChI=1S/C33H56O14/c1-18-14-12-10-8-6-4-3-5-7-9-11-13-15-20-23(19(2)30(40)43-20)31(41)46-28-26(38)24(36)22(17-35)45-33(28)47-29-27(39)25(37)21(16-34)44-32(29)42-18/h18-29,32-39H,3-17H2,1-2H3/t18-,19?,20+,21-,22-,23+,24-,25-,26+,27+,28-,29-,32-,33+/m0/s1 |
| InChIKey | NFJPUMMCMMCPKZ-DZSYTUNISA-N |
| Mol Weight | 676.8 g/mol |
| Molecular Formula | C33H56O14 |
| Exact Mass | 676.367006 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DmtQjScGjW4 |
|---|---|
| Name | GOBIENINE-A;(18R)-18-HYDROXYDIHYDROALLOPROTOLICHESTERINIC-ACID-18-O-BETA-D-GLUCOPYRANOSYL-(1''->2')-O-BETA-D-GLUCOPYRANOSIDE-(21,2''-LACTONE) |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H56O14 |
| InChI | InChI=1S/C33H56O14/c1-18-14-12-10-8-6-4-3-5-7-9-11-13-15-20-23(19(2)30(40)43-20)31(41)46-28-26(38)24(36)22(17-35)45-33(28)47-29-27(39)25(37)21(16-34)44-32(29)42-18/h18-29,32-39H,3-17H2,1-2H3/t18-,19?,20+,21-,22-,23+,24-,25-,26+,27+,28-,29-,32-,33+/m0/s1 |
| InChIKey | NFJPUMMCMMCPKZ-DZSYTUNISA-N |
| Literature Reference Author | T.REZANKA,I.A.GUSCHINA |
| Literature Reference Citation | PHYTOCHEM.,58,1281(2001) |
| Literature Reference DOI | 10.1016/S0031-9422(01)00388-0 |
| Molecular Weight | 676.799 g/mol |
| Solvent | Unknown |
| Source File Reference | UWLU3180 |