| SpectraBase Compound ID | LjzwE00wBS |
|---|---|
| InChI | InChI=1S/C27H38O10/c1-15(2)8-22(29)35-14-27(32)21(36-23(30)9-16(3)4)11-20-19(12-33-18(7)28)13-34-26(25(20)27)37-24(31)10-17(5)6/h10-11,13,15-16,21,25-26,32H,8-9,12,14H2,1-7H3/t21-,25+,26-,27+/m0/s1 |
| InChIKey | HCGUNEDCTVLVNP-HVLDEAOBSA-N |
| Mol Weight | 522.6 g/mol |
| Molecular Formula | C27H38O10 |
| Exact Mass | 522.246497 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6odeeKpo8dY |
|---|---|
| Name | VALTRATE_HYDRINE_B_7 |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H38O10 |
| InChI | InChI=1S/C27H38O10/c1-15(2)8-22(29)35-14-27(32)21(36-23(30)9-16(3)4)11-20-19(12-33-18(7)28)13-34-26(25(20)27)37-24(31)10-17(5)6/h10-11,13,15-16,21,25-26,32H,8-9,12,14H2,1-7H3/t21-,25+,26-,27+/m0/s1 |
| InChIKey | HCGUNEDCTVLVNP-HVLDEAOBSA-N |
| Literature Reference Author | Y.M.XU,S.P.MCLAUGHLIN,A.A.L.GUNATILAKA |
| Literature Reference Citation | J.NAT.PROD.,70,2045(2007) |
| Literature Reference DOI | 10.1021/np0704553 |
| Molecular Weight | 522.593 g/mol |
| Sample ID | 31289 |
| Solvent | CDCl3 |