| SpectraBase Compound ID | Hk5XkpLHQpC |
|---|---|
| InChI | InChI=1S/C30H48O3/c1-25(2)21-10-13-30(7)22(28(21,5)12-11-23(25)31)9-8-19-20-18-27(4,24(32)33)15-14-26(20,3)16-17-29(19,30)6/h8,20-23,31H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,23+,26+,27+,28-,29+,30+/m0/s1 |
| InChIKey | JZFSMVXQUWRSIW-MCLQAGPZSA-N |
| Mol Weight | 456.7 g/mol |
| Molecular Formula | C30H48O3 |
| Exact Mass | 456.360345 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9mmnaQt9kvz |
|---|---|
| Name | KATANIC-ACID;3-ALPHA-HYDROXY-OLEAN-12-EN-29-OIC-ACID |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H48O3 |
| InChI | InChI=1S/C30H48O3/c1-25(2)21-10-13-30(7)22(28(21,5)12-11-23(25)31)9-8-19-20-18-27(4,24(32)33)15-14-26(20,3)16-17-29(19,30)6/h8,20-23,31H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,23+,26+,27+,28-,29+,30+/m0/s1 |
| InChIKey | JZFSMVXQUWRSIW-MCLQAGPZSA-N |
| Literature Reference Author | N.KANEDA,J.M.PEZZUTO,A.D.KINGHORN,N.R.FARNSWORTH,T.SANTISUK, P.TUCHINDA,J.UDACHAC |
| Literature Reference Citation | J.NAT.PROD.,55,654(1992) |
| Literature Reference DOI | 10.1021/np50083a016 |
| Molecular Weight | 456.709 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCS4172 |