| SpectraBase Compound ID | GmRqpWvXVFj |
|---|---|
| InChI | InChI=1S/C28H39ClO12/c1-14(2)9-21(38-16(4)31)24(39-17(5)32)20-11-36-26(40-18(6)33)23-19(20)7-8-27(34,12-29)25-22(41-25)10-28(23,35)13-37-15(3)30/h9,11,19,21-26,34-35H,7-8,10,12-13H2,1-6H3/t19-,21+,22-,23+,24-,25-,26-,27-,28-/m1/s1 |
| InChIKey | DFXPNEIBBQPODQ-DXXKCEMVSA-N |
| Mol Weight | 603.1 g/mol |
| Molecular Formula | C28H39ClO12 |
| Exact Mass | 602.213004 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 47egsVrh1lj |
|---|---|
| Name | 19-ACETOXY-18-CHLORO-7,11-HAVANNADIOL |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H39ClO12 |
| InChI | InChI=1S/C28H39ClO12/c1-14(2)9-21(38-16(4)31)24(39-17(5)32)20-11-36-26(40-18(6)33)23-19(20)7-8-27(34,12-29)25-22(41-25)10-28(23,35)13-37-15(3)30/h9,11,19,21-26,34-35H,7-8,10,12-13H2,1-6H3/t19-,21+,22-,23+,24-,25-,26-,27-,28-/m1/s1 |
| InChIKey | DFXPNEIBBQPODQ-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 | 603.063 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED16890 |