| SpectraBase Spectrum ID |
CyScFoynxab |
| Name |
AJUGACILIATIN_J;4-ALPHA,6-ALPHA,19-TRIHYDROXY-18-TIGLOYLOXY-NEO-CLEROD-13-EN-15,16-OLIDE |
| Compound Number |
12 |
| Copyright |
Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C25H38O7 |
| InChI |
InChI=1S/C25H38O7/c1-5-16(2)22(29)32-15-24(30)9-6-7-19-23(4,10-8-18-12-21(28)31-13-18)17(3)11-20(27)25(19,24)14-26/h5,12,17,19-20,26-27,30H,6-11,13-15H2,1-4H3/b16-5+/t17-,19-,20+,23+,24+,25+/m1/s1 |
| InChIKey |
MKJOVGRMTQOYAQ-DONKYKGPSA-N |
| Literature Reference Author |
P.GUO,Y.LI,J.XU,C.LIU,Y.MA,Y.GUO |
| Literature Reference Citation |
J.NAT.PROD.,74,1575(2011) |
| Literature Reference DOI |
10.1021/np2001557 |
| Molecular Weight |
450.573 g/mol |
| Sample ID |
39022 |
| Solvent |
CDCl3 |
