| SpectraBase Compound ID | LAXiEYriAr |
|---|---|
| InChI | InChI=1S/C30H46O4/c1-25(2)21-9-12-29(6)22(28(21,5)11-10-23(25)32)8-7-19-20-17-26(3,18-31)13-14-27(20,4)15-16-30(19,29)24(33)34/h7,18,20-23,32H,8-17H2,1-6H3,(H,33,34)/t20-,21-,22+,23+,26+,27+,28-,29+,30+/m0/s1 |
| InChIKey | LNGFEBDEYRAODZ-MCLQAGPZSA-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 | ADi6kLmq6IW |
|---|---|
| Name | 3-ALPHA-HYDROXY-29-OXOOLEAN-12-EN-27-OIC-ACID |
| CAS Registry Number | 86727-51-7 |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O4 |
| InChI | InChI=1S/C30H46O4/c1-25(2)21-9-12-29(6)22(28(21,5)11-10-23(25)32)8-7-19-20-17-26(3,18-31)13-14-27(20,4)15-16-30(19,29)24(33)34/h7,18,20-23,32H,8-17H2,1-6H3,(H,33,34)/t20-,21-,22+,23+,26+,27+,28-,29+,30+/m0/s1 |
| InChIKey | LNGFEBDEYRAODZ-MCLQAGPZSA-N |
| Literature Reference Author | T.K.CHEN,D.C.ALES,N.C.BAENZIGER,D.F.WIEMER |
| Literature Reference Citation | J.ORG.CHEM.,48,3525(1983) |
| Literature Reference DOI | 10.1021/jo00168a030 |
| Molecular Weight | 470.693 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UNIW11630 |