| SpectraBase Compound ID | 41K44tzOxhW |
|---|---|
| InChI | InChI=1S/C34H46O11/c1-8-9-10-11-12-13-14-15-25(37)44-28-26-29-32(45-29,18-42-22(6)35)30(43-23(7)36)34(41)24(16-20(4)27(34)38)33(26,40)21(5)17-31(28,39)19(2)3/h12-16,21,24,26,28-30,39-41H,2,8-11,17-18H2,1,3-7H3/b13-12+,15-14+/t21-,24?,26?,28-,29+,30-,31-,32+,33+,34-/m1/s1 |
| InChIKey | YZDGHHXVEFIULE-DLWDDHHKSA-N |
| Mol Weight | 630.7 g/mol |
| Molecular Formula | C34H46O11 |
| Exact Mass | 630.304012 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IfMejTbSyIb |
|---|---|
| Name | VESICULOSIN-ACETATE |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H46O11 |
| InChI | InChI=1S/C34H46O11/c1-8-9-10-11-12-13-14-15-25(37)44-28-26-29-32(45-29,18-42-22(6)35)30(43-23(7)36)34(41)24(16-20(4)27(34)38)33(26,40)21(5)17-31(28,39)19(2)3/h12-16,21,24,26,28-30,39-41H,2,8-11,17-18H2,1,3-7H3/b13-12+,15-14+/t21-,24?,26?,28-,29+,30-,31-,32+,33+,34-/m1/s1 |
| InChIKey | YZDGHHXVEFIULE-DLWDDHHKSA-N |
| Literature Reference Author | R.G.POWELL,D.WEISLEDER,C.R.SMITH |
| Literature Reference Citation | J.NAT.PROD.,48,102(1985) |
| Literature Reference DOI | 10.1021/np50037a018 |
| Molecular Weight | 630.733 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS3571 |