| SpectraBase Compound ID | 7JTiqTLD1pK |
|---|---|
| InChI | InChI=1S/C30H46O4/c1-18(15-20(31)16-19(2)25(33)34)21-9-11-28(6)23-8-7-22-26(3,4)24(32)10-12-29(22)17-30(23,29)14-13-27(21,28)5/h18,21-24,32H,2,7-17H2,1,3-6H3,(H,33,34)/t18-,21-,22+,23+,24-,27-,28+,29-,30+/m1/s1 |
| InChIKey | RLFMRPTURODVTO-DSQNFODDSA-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 | 1B0FYx7ePkc |
|---|---|
| Name | (+)-REL-3-ALPHA-HYDROXY-23-OXOCYCLOART-25(27)-EN-26-OIC-ACID |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O4 |
| InChI | InChI=1S/C30H46O4/c1-18(15-20(31)16-19(2)25(33)34)21-9-11-28(6)23-8-7-22-26(3,4)24(32)10-12-29(22)17-30(23,29)14-13-27(21,28)5/h18,21-24,32H,2,7-17H2,1,3-6H3,(H,33,34)/t18-,21-,22+,23+,24-,27-,28+,29-,30+/m1/s1 |
| InChIKey | RLFMRPTURODVTO-DSQNFODDSA-N |
| Literature Reference Author | S.LAVOIE,C.GAUTHIER,J.LEGAULT,S.MERCIER,V.MSHVILDADZE,A.PICH ETTE |
| Literature Reference Citation | BEIL.J.ORG.CHEM.,9,1333(2013) |
| Literature Reference DOI | 10.3762/bjoc.9.150 |
| Molecular Weight | 470.693 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU77115 |