SpectraBase Compound ID | 98MnTZXyqGW |
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InChI | InChI=1S/C24H34O6/c1-22-7-5-15(25)9-14(22)10-18(26)21-16(22)6-8-23(2)17(11-19(27)24(21,23)29)13-3-4-20(28)30-12-13/h3-4,12,14-19,21,25-27,29H,5-11H2,1-2H3/t14-,15-,16?,17+,18-,19-,21-,22-,23+,24-/m0/s1 |
InChIKey | JJVRUFOCQNBNGS-YBWMTCOWSA-N |
Mol Weight | 418.5 g/mol |
Molecular Formula | C24H34O6 |
Exact Mass | 418.235539 g/mol |
SpectraBase Spectrum ID | fDmsSsy6El |
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Name | 7-BETA,15-ALPHA-DIHYDROXY-BUFALIN |
Compound Number | 6 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C24H34O6 |
InChI | InChI=1S/C24H34O6/c1-22-7-5-15(25)9-14(22)10-18(26)21-16(22)6-8-23(2)17(11-19(27)24(21,23)29)13-3-4-20(28)30-12-13/h3-4,12,14-19,21,25-27,29H,5-11H2,1-2H3/t14-,15-,16?,17+,18-,19-,21-,22-,23+,24-/m0/s1 |
InChIKey | JJVRUFOCQNBNGS-YBWMTCOWSA-N |
Literature Reference Author | M.YE,J.HAN,G.TU,D.AN,D.GUO |
Literature Reference Citation | J.NAT.PROD.,68,626(2005) |
Literature Reference DOI | 10.1021/np0500023 |
Molecular Weight | 418.530 g/mol |
Solvent | DMSO-D6 |
Source File Reference | UWMZ9374 |