| SpectraBase Compound ID | GFjvWI8t9rU |
|---|---|
| InChI | InChI=1S/C30H46O4/c1-17(2)19-14-21(33)25-29(7)11-8-18-24(28(29,6)12-13-30(19,25)16-31)20(32)15-22-26(3,4)23(34)9-10-27(18,22)5/h8-10,17,19-22,24-25,31-33H,11-16H2,1-7H3/t19-,20-,21+,22-,24-,25+,27+,28-,29+,30+/m0/s1 |
| InChIKey | LKBSFVITHXLCDA-MEKJSECDSA-N |
| Mol Weight | 470.7 g/mol |
| Molecular Formula | C30H46O4 |
| Exact Mass | 470.33961 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5HJ1trAFHT6 |
|---|---|
| Name | RUBIARBONONE-E;7-BETA,19-ALPHA,28-TRIHYDROXYARBOR-1(2),9(11)-DIEN-3-ONE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O4 |
| InChI | InChI=1S/C30H46O4/c1-17(2)19-14-21(33)25-29(7)11-8-18-24(28(29,6)12-13-30(19,25)16-31)20(32)15-22-26(3,4)23(34)9-10-27(18,22)5/h8-10,17,19-22,24-25,31-33H,11-16H2,1-7H3/t19-,20-,21+,22-,24-,25+,27+,28-,29+,30+/m0/s1 |
| InChIKey | LKBSFVITHXLCDA-MEKJSECDSA-N |
| Literature Reference Author | M.J.LIOU,T.S.WU |
| Literature Reference Citation | J.NAT.PROD.,65,1283(2002) |
| Literature Reference DOI | 10.1021/np020038k |
| Molecular Weight | 470.693 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWSI5184 |