| SpectraBase Compound ID | AgktXJ1OJ4t |
|---|---|
| InChI | InChI=1S/C34H50O9/c1-18-11-14-34(28(39)40)16-15-30(5)21(25(34)33(18,8)41)9-10-23-29(4)17-22(42-19(2)35)26(43-20(3)36)32(7,27(37)38)24(29)12-13-31(23,30)6/h9,18,22-26,41H,10-17H2,1-8H3,(H,37,38)(H,39,40)/t18-,22-,23?,24?,25?,26+,29-,30-,31-,32-,33+,34+/m1/s1 |
| InChIKey | YOFQGOPKBFTSNZ-VOFWPZMASA-N |
| Mol Weight | 602.8 g/mol |
| Molecular Formula | C34H50O9 |
| Exact Mass | 602.345483 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4TLYBudkjef |
|---|---|
| Name | 2-ALPHA,3-BETA-DI-O-ACETYL-19-ALPHA-HYDROXY-URS-12-ENE-24,28-DIOIC-ACID |
| Compound Number | 2A |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H50O9 |
| InChI | InChI=1S/C34H50O9/c1-18-11-14-34(28(39)40)16-15-30(5)21(25(34)33(18,8)41)9-10-23-29(4)17-22(42-19(2)35)26(43-20(3)36)32(7,27(37)38)24(29)12-13-31(23,30)6/h9,18,22-26,41H,10-17H2,1-8H3,(H,37,38)(H,39,40)/t18-,22-,23?,24?,25?,26+,29-,30-,31-,32-,33+,34+/m1/s1 |
| InChIKey | YOFQGOPKBFTSNZ-VOFWPZMASA-N |
| Literature Reference Author | F.W.L.ARAUJO,M.P.SOUZA,R.B.FILHO |
| Literature Reference Citation | J.NAT.PROD.,53,1436(1990) |
| Literature Reference DOI | 10.1021/np50072a006 |
| Molecular Weight | 602.766 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWCS23187 |