| SpectraBase Compound ID | LhKgZRRhghm |
|---|---|
| InChI | InChI=1S/C30H48O2/c1-25(2)17-20-19-9-10-22-28(6)13-12-23(31)26(3,4)21(28)11-14-30(22,8)29(19,7)16-15-27(20,5)18-24(25)32/h9,20-22,24,32H,10-18H2,1-8H3/t20-,21-,22+,24-,27-,28-,29+,30+/m0/s1 |
| InChIKey | CYAGVDMNRPMVDV-ZMIVVTAWSA-N |
| Mol Weight | 440.7 g/mol |
| Molecular Formula | C30H48O2 |
| Exact Mass | 440.365431 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1IeMd5ccg6I |
|---|---|
| Name | 21-BETA-HYDROXY-OLEAN-12-EN-3-ONE;21-BETA-HYDROXY-BETA-AMYRINONE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2023 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H48O2 |
| InChI | InChI=1S/C30H48O2/c1-25(2)17-20-19-9-10-22-28(6)13-12-23(31)26(3,4)21(28)11-14-30(22,8)29(19,7)16-15-27(20,5)18-24(25)32/h9,20-22,24,32H,10-18H2,1-8H3/t20-,21-,22+,24-,27-,28-,29+,30+/m0/s1 |
| InChIKey | CYAGVDMNRPMVDV-ZMIVVTAWSA-N |
| Literature Reference Author | G.J.MENA-REJON,A.R.PEREZ-ESPADAS,R.E.MOO-PUC,R.CEDILLO-RIVER A,I.L.BAZZOCCHI,I.A. |
| Literature Reference Citation | J.NAT.PROD.,70,863(2007) |
| Literature Reference DOI | 10.1021/np060559y |
| Molecular Weight | 440.710 g/mol |
| Sample ID | 30340 |
| Solvent | CDCl3 |