![3-O-[6'-O-PALMITOYL-BETA-D-GLUCOPYRANOSYL]-SPINASTA-7,22(23)-DIENE](/api/spectrum/DNzLlG9vEfe/structure.png?h=300&w=458 "3-O-[6'-O-PALMITOYL-BETA-D-GLUCOPYRANOSYL]-SPINASTA-7,22(23)-DIENE")
| SpectraBase Compound ID | 6mIWCVXsJf8 |
|---|---|
| InChI | InChI=1S/C51H88O7/c1-8-10-11-12-13-14-15-16-17-18-19-20-21-22-45(52)56-34-44-46(53)47(54)48(55)49(58-44)57-39-29-31-50(6)38(33-39)25-26-40-42-28-27-41(51(42,7)32-30-43(40)50)36(5)23-24-37(9-2)35(3)4/h23-24,26,35-39,41-44,46-49,53-55H,8-22,25,27-34H2,1-7H3/b24-23+/t36?,37-,38?,39-,41?,42?,43?,44+,46+,47-,48+,49+,50-,51+/m0/s1 |
| InChIKey | MHTLMDOOOKZQCO-MOHMQLSKSA-N |
| Mol Weight | 813.3 g/mol |
| Molecular Formula | C51H88O7 |
| Exact Mass | 812.653005 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 | DNzLlG9vEfe |
|---|---|
| Name | 3-O-[6'-O-PALMITOYL-BETA-D-GLUCOPYRANOSYL]-SPINASTA-7,22(23)-DIENE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C51H88O7 |
| InChI | InChI=1S/C51H88O7/c1-8-10-11-12-13-14-15-16-17-18-19-20-21-22-45(52)56-34-44-46(53)47(54)48(55)49(58-44)57-39-29-31-50(6)38(33-39)25-26-40-42-28-27-41(51(42,7)32-30-43(40)50)36(5)23-24-37(9-2)35(3)4/h23-24,26,35-39,41-44,46-49,53-55H,8-22,25,27-34H2,1-7H3/b24-23+/t36?,37-,38?,39-,41?,42?,43?,44+,46+,47-,48+,49+,50-,51+/m0/s1 |
| InChIKey | MHTLMDOOOKZQCO-MOHMQLSKSA-N |
| Literature Reference Author | D.D.C.F.GOMES,L.V.ALEGRIO |
| Literature Reference Citation | PHYTOCHEM.,49,1365(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00925-4 |
| Molecular Weight | 813.256 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU548 |