| Name |
Ajugachin A |
| Formula |
C28H40O10 |
| Mw |
536.2621475 |
| CAS RN |
131086-64-1 |
| C_ID |
C00040864
, 
|
| InChIKey |
MZEYOXXDMOFRMK-YQXJDAAENA-N |
| InChICode |
InChI=1S/C28H40O10/c1-14(2)24(32)38-23-19(31)11-20-26(6,21-10-18-7-8-33-25(18)37-21)15(3)9-22(36-17(5)30)27(20,12-34-16(4)29)28(23)13-35-28/h7-8,14-15,18-23,25,31H,9-13H2,1-6H3/t15-,18+,19-,20-,21-,22+,23+,25+,26+,27+,28-/m1/s1 |
| SMILES |
CC(=O)OC[C@@]12[C@@H](OC(C)=O)C[C@@H](C)[C@](C)([C@H]3C[C@@H]4C=CO[C@@H]4O3)[C@H]1C[C@@H](O)[C@H](OC(=O)C(C)C)[C@]21CO1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Labiatae | Ajuga reptans  | Ref. |
|
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