| SpectraBase Spectrum ID |
Is75PiJplPG |
| Name |
AJUGACILIATIN_I;18-ACETOXY-4-ALPHA,6-ALPHA-DIHYDROXY-19-TIGLOYLOXY-NEO-CLEROD-13-EN-15,16-OLIDE |
| Compound Number |
11 |
| Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C27H40O8 |
| InChI |
InChI=1S/C27H40O8/c1-6-17(2)24(31)35-16-27-21(8-7-10-26(27,32)15-34-19(4)28)25(5,18(3)12-22(27)29)11-9-20-13-23(30)33-14-20/h6,13,18,21-22,29,32H,7-12,14-16H2,1-5H3/b17-6+/t18-,21-,22+,25+,26+,27+/m1/s1 |
| InChIKey |
AMVXZRRATHTNNC-PIJHPVSDSA-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 |
492.610 g/mol |
| Sample ID |
39021 |
| Solvent |
CDCl3 |
