| SpectraBase Compound ID | 7XwIm2sqzFw |
|---|---|
| InChI | InChI=1S/C34H54O7/c1-20(36)40-26-13-14-31(6)24(29(26,3)4)12-15-33(8)25(31)11-10-22-23-18-34(19-35,39-9)27(38)28(41-21(2)37)30(23,5)16-17-32(22,33)7/h10,23-28,35,38H,11-19H2,1-9H3/t23-,24-,25+,26+,27+,28-,30+,31-,32+,33+,34-/m0/s1 |
| InChIKey | TTXBPFDTNBYSHA-FOHBVDNRSA-N |
| Mol Weight | 574.8 g/mol |
| Molecular Formula | C34H54O7 |
| Exact Mass | 574.386954 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 88N52GFn0ok |
|---|---|
| Name | 3-ALPHA,22-ALPHA-DIACETOXY-21-ALPHA,28-DIHYDROXY-20-BETA-METHOXY-30-NOROLEAN-12-ENE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H54O7 |
| InChI | InChI=1S/C34H54O7/c1-20(36)40-26-13-14-31(6)24(29(26,3)4)12-15-33(8)25(31)11-10-22-23-18-34(19-35,39-9)27(38)28(41-21(2)37)30(23,5)16-17-32(22,33)7/h10,23-28,35,38H,11-19H2,1-9H3/t23-,24-,25+,26+,27+,28-,30+,31-,32+,33+,34-/m0/s1 |
| InChIKey | TTXBPFDTNBYSHA-FOHBVDNRSA-N |
| Literature Reference Author | C.M.LIU,H.X.WANG,S.L.WEI,K.GAO |
| Literature Reference Citation | J.NAT.PROD.,71,789(2008) |
| Literature Reference DOI | 10.1021/np070618n |
| Molecular Weight | 574.799 g/mol |
| Sample ID | 28233 |
| Solvent | CDCl3 |