| SpectraBase Spectrum ID |
22ES1Mi4Nyd |
| Name |
3-ALPHA,16-BETA,28-TRIHYDROXYLUP-20-(29)-ENE;28-HYDROXY-3-EPICALENDULADIOL |
| Compound Number |
1 |
| Copyright |
Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C30H50O3 |
| InChI |
InChI=1S/C30H50O3/c1-18(2)19-10-15-30(17-31)24(33)16-29(7)20(25(19)30)8-9-22-27(5)13-12-23(32)26(3,4)21(27)11-14-28(22,29)6/h19-25,31-33H,1,8-17H2,2-7H3/t19-,20+,21-,22+,23+,24-,25+,27-,28+,29+,30-/m0/s1 |
| InChIKey |
TWKNDDJHVQUEJF-AJZBJTNWSA-N |
| Literature Reference Author |
N.E.J.VAZDEKIS,H.CHAVEZ,A.ESTEVEZ-BRAUN,A.G.RAVELO |
| Literature Reference Citation |
J.NAT.PROD.,72,1045(2009) |
| Literature Reference DOI |
10.1021/np800594a |
| Molecular Weight |
458.725 g/mol |
| Sample ID |
32712 |
| Solvent |
CDCl3 |
