| SpectraBase Compound ID | 7XUysdG9BkD |
|---|---|
| InChI | InChI=1S/C32H48O7/c1-18(17-33)20-9-14-32(27(37)38)16-15-29(4)21(25(20)32)7-8-22-28(3)12-11-24(39-19(2)34)31(6,26(35)36)23(28)10-13-30(22,29)5/h20-25,33H,1,7-17H2,2-6H3,(H,35,36)(H,37,38)/t20-,21+,22+,23+,24+,25+,28+,29+,30+,31-,32-/m0/s1 |
| InChIKey | LIKVRUAPPXCRHS-ZESURFQCSA-N |
| Mol Weight | 544.7 g/mol |
| Molecular Formula | C32H48O7 |
| Exact Mass | 544.340004 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KUWZHemdoN5 |
|---|---|
| Name | ACANTRIFOIC-ACID-A;3-ALPHA-ACETOXY-30-HYDROXY-LUP-20(29)-ENE-23,28-DIOIC-ACID |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H48O7 |
| InChI | InChI=1S/C32H48O7/c1-18(17-33)20-9-14-32(27(37)38)16-15-29(4)21(25(20)32)7-8-22-28(3)12-11-24(39-19(2)34)31(6,26(35)36)23(28)10-13-30(22,29)5/h20-25,33H,1,7-17H2,2-6H3,(H,35,36)(H,37,38)/t20-,21+,22+,23+,24+,25+,28+,29+,30+,31-,32-/m0/s1 |
| InChIKey | LIKVRUAPPXCRHS-ZESURFQCSA-N |
| Literature Reference Author | P.V.KIEM,X.F.CAI,C.V.MINH,J.J.LEE,Y.H.KIM |
| Literature Reference Citation | CHEM.PHARM.BULL.,51,1432(2003) |
| Literature Reference DOI | 10.1248/cpb.51.1432 |
| Molecular Weight | 544.729 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU20558 |