| SpectraBase Compound ID | 3VxbbbIX7wu |
|---|---|
| InChI | InChI=1S/C28H38O12/c1-14(2)9-21(37-16(4)30)24(38-17(5)31)20-11-34-26(39-18(6)32)23-19(20)7-8-28(13-36-28)25-22(40-25)10-27(23,33)12-35-15(3)29/h9,11,19,21-26,33H,7-8,10,12-13H2,1-6H3/t19-,21+,22-,23+,24-,25-,26-,27-,28-/m1/s1 |
| InChIKey | RROWAZSHHIATKA-DXXKCEMVSA-N |
| Mol Weight | 566.6 g/mol |
| Molecular Formula | C28H38O12 |
| Exact Mass | 566.236327 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K2SzhBf3BYK |
|---|---|
| Name | 19-ACETOXY-11-HAVANNAHOL |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H38O12 |
| InChI | InChI=1S/C28H38O12/c1-14(2)9-21(37-16(4)30)24(38-17(5)31)20-11-34-26(39-18(6)32)23-19(20)7-8-28(13-36-28)25-22(40-25)10-27(23,33)12-35-15(3)29/h9,11,19,21-26,33H,7-8,10,12-13H2,1-6H3/t19-,21+,22-,23+,24-,25-,26-,27-,28-/m1/s1 |
| InChIKey | RROWAZSHHIATKA-DXXKCEMVSA-N |
| Literature Reference Author | A.ALMOURABIT,A.AHOND,C.POUPAT,P.POTIER |
| Literature Reference Citation | J.NAT.PROD.,53,894(1990) |
| Literature Reference DOI | 10.1021/np50070a017 |
| Molecular Weight | 566.603 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED16889 |