| SpectraBase Compound ID | 7Q9NdyTZRes |
|---|---|
| InChI | InChI=1S/C28H43ClO9/c1-11-15(3)25(32)37-20(14-22(31)27(7,8)35-10)17(5)19-13-21(29)28(9,34)24(36-18(6)30)23(19)38-26(33)16(4)12-2/h11-12,19-24,31,34H,5,13-14H2,1-4,6-10H3/b15-11+,16-12+/t19-,20-,21+,22-,23+,24+,28-/m1/s1 |
| InChIKey | MEKMYFPRTQLJAW-PCULJKBJSA-N |
| Mol Weight | 559.1 g/mol |
| Molecular Formula | C28H43ClO9 |
| Exact Mass | 558.259561 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2ab0ATYGuCs |
|---|---|
| Name | 2-BETA-ACETOXY-4-ALPHA-CHLORO-1-BETA,8-DIANGELOYLOXY-3-BETA,10-DIHYDROXY-11-METHOXYBISABOL-7(14)-ENE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H43ClO9 |
| InChI | InChI=1S/C28H43ClO9/c1-11-15(3)25(32)37-20(14-22(31)27(7,8)35-10)17(5)19-13-21(29)28(9,34)24(36-18(6)30)23(19)38-26(33)16(4)12-2/h11-12,19-24,31,34H,5,13-14H2,1-4,6-10H3/b15-11+,16-12+/t19-,20-,21+,22-,23+,24+,28-/m1/s1 |
| InChIKey | MEKMYFPRTQLJAW-PCULJKBJSA-N |
| Literature Reference Author | Y.ZHU,L.YANG,Z.J.JIA |
| Literature Reference Citation | J.NAT.PROD.,62,1479(1999) |
| Literature Reference DOI | 10.1021/np990044p |
| Molecular Weight | 559.097 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS21571 |