| SpectraBase Compound ID | 2UYnwowjJVE |
|---|---|
| InChI | InChI=1S/C28H34O9/c1-14(29)33-19-11-18-24(2,3)35-16-10-20(30)36-27(18,12-16)17-6-8-25(4)21(15-7-9-32-13-15)34-23(31)22-28(25,37-22)26(17,19)5/h7,9,13,16-19,21-22H,6,8,10-12H2,1-5H3/t16-,17-,18-,19+,21-,22+,25-,26-,27-,28+/m0/s1 |
| InChIKey | MZPMDBUZYDUIEJ-FGIJUYGLSA-N |
| Mol Weight | 514.6 g/mol |
| Molecular Formula | C28H34O9 |
| Exact Mass | 514.220283 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6vqEowcithi |
|---|---|
| Name | 1-(10->19)-ABEO-7-ALPHA-ACETOXY-10-BETA-HYDROXY-ISO-OBACUNOIC-ACID-3,10-LACTONE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H34O9 |
| InChI | InChI=1S/C28H34O9/c1-14(29)33-19-11-18-24(2,3)35-16-10-20(30)36-27(18,12-16)17-6-8-25(4)21(15-7-9-32-13-15)34-23(31)22-28(25,37-22)26(17,19)5/h7,9,13,16-19,21-22H,6,8,10-12H2,1-5H3/t16-,17-,18-,19+,21-,22+,25-,26-,27-,28+/m0/s1 |
| InChIKey | MZPMDBUZYDUIEJ-FGIJUYGLSA-N |
| Literature Reference Author | E.M.K.WIJERATNE,B.M.R.BANDARA,A.A.L.GUNATILAKA,Y.TEZUKA,T.KI KUCHI |
| Literature Reference Citation | J.NAT.PROD.,55,1261(1992) |
| Literature Reference DOI | 10.1021/np50087a013 |
| Molecular Weight | 514.573 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWTS199 |