| SpectraBase Compound ID | 3PI0kZw8RAP |
|---|---|
| InChI | InChI=1S/C30H48O6/c1-25(2)13-18-17-7-8-21-26(3)14-19(32)23(34)27(4,16-31)20(26)9-10-29(21,6)28(17,5)11-12-30(18,24(35)36)15-22(25)33/h7,18-23,31-34H,8-16H2,1-6H3,(H,35,36)/t18-,19-,20-,21?,22+,23+,26+,27+,28-,29-,30-/m1/s1 |
| InChIKey | ADFYMFQYUQYEQP-DBUTZYKTSA-N |
| Mol Weight | 504.7 g/mol |
| Molecular Formula | C30H48O6 |
| Exact Mass | 504.345089 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FJCwS8tn5sR |
|---|---|
| Name | 2-ALPHA,3-BETA,21-BETA,23-TETRAHYDROXYOLEAN-12-EN-28-OIC-ACID |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H48O6 |
| InChI | InChI=1S/C30H48O6/c1-25(2)13-18-17-7-8-21-26(3)14-19(32)23(34)27(4,16-31)20(26)9-10-29(21,6)28(17,5)11-12-30(18,24(35)36)15-22(25)33/h7,18-23,31-34H,8-16H2,1-6H3,(H,35,36)/t18-,19-,20-,21?,22+,23+,26+,27+,28-,29-,30-/m1/s1 |
| InChIKey | ADFYMFQYUQYEQP-DBUTZYKTSA-N |
| Literature Reference Author | F.N.NGOUNOU,A.U.RAHMAN,M.I.CHOUDHARY,S.MALIK,S.ZAREEN,R.ALI, D.LONTSI,B.L.SONDENG |
| Literature Reference Citation | PHYTOCHEM.,52,917(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(99)00250-2 |
| Molecular Weight | 504.708 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVN520 |