| SpectraBase Compound ID | KpIgVBKK2jf |
|---|---|
| InChI | InChI=1S/C33H52O4/c1-27(2)15-17-33(26(34)35)18-16-31(7)21(22(33)19-27)9-10-24-29(5)13-12-25-30(6,20-36-28(3,4)37-25)23(29)11-14-32(24,31)8/h9,22-25H,10-20H2,1-8H3,(H,34,35)/t22-,23+,24+,25-,29-,30-,31+,32+,33-/m0/s1 |
| InChIKey | GZTXRAOZNVKIDQ-ZOGWWOATSA-N |
| Mol Weight | 512.8 g/mol |
| Molecular Formula | C33H52O4 |
| Exact Mass | 512.38656 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7yE54qtEB8n |
|---|---|
| Name | 3-BETA,23-O-ISOPROPYLIDENYL-3-BETA,23-DIHYDROXY-OLEAN-12-EN-28-OIC-ACID |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H52O4 |
| InChI | InChI=1S/C33H52O4/c1-27(2)15-17-33(26(34)35)18-16-31(7)21(22(33)19-27)9-10-24-29(5)13-12-25-30(6,20-36-28(3,4)37-25)23(29)11-14-32(24,31)8/h9,22-25H,10-20H2,1-8H3,(H,34,35)/t22-,23+,24+,25-,29-,30-,31+,32+,33-/m0/s1 |
| InChIKey | GZTXRAOZNVKIDQ-ZOGWWOATSA-N |
| Literature Reference Author | Y.S.WANG,R.HUANG,N.Z.LI,H.Y.XU,J.H.YANG |
| Literature Reference Citation | MOLECULES,15,2096(2010) |
| Literature Reference DOI | 10.3390/molecules15042096 |
| Molecular Weight | 512.773 g/mol |
| Sample ID | 70197 |
| Solvent | CDCl3 |