| SpectraBase Compound ID | DNe9hV3CCKj |
|---|---|
| InChI | InChI=1S/C30H46O6/c1-25(17-31)12-14-30(24(35)36)15-13-27(3)18(19(30)16-25)6-7-20-26(2)10-9-22(32)29(5,23(33)34)21(26)8-11-28(20,27)4/h6,19-22,31-32H,7-17H2,1-5H3,(H,33,34)(H,35,36)/t19-,20+,21+,22-,25+,26+,27+,28+,29-,30-/m0/s1 |
| InChIKey | DONPTFNDUAGNOP-ZGILKNCOSA-N |
| Mol Weight | 502.7 g/mol |
| Molecular Formula | C30H46O6 |
| Exact Mass | 502.329439 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EUCRKr51Pt9 |
|---|---|
| Name | 3-BETA,29-DIHYDROXY-OLEAN-12-EN-23,28-DIOIC-ACID |
| Compound Number | 3A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O6 |
| InChI | InChI=1S/C30H46O6/c1-25(17-31)12-14-30(24(35)36)15-13-27(3)18(19(30)16-25)6-7-20-26(2)10-9-22(32)29(5,23(33)34)21(26)8-11-28(20,27)4/h6,19-22,31-32H,7-17H2,1-5H3,(H,33,34)(H,35,36)/t19-,20+,21+,22-,25+,26+,27+,28+,29-,30-/m0/s1 |
| InChIKey | DONPTFNDUAGNOP-ZGILKNCOSA-N |
| Literature Reference Author | S.Y.PARK,C.S.YOOK,T.NOHARA |
| Literature Reference Citation | CHEM.PHARM.BULL.,53,1147(2005) |
| Literature Reference DOI | 10.1248/cpb.53.1147 |
| Molecular Weight | 502.692 g/mol |
| Sample ID | 54135 |
| Solvent | C5D5N |