| Name |
Ajugasterone C |
| Formula |
C27H44O7 |
| Mw |
480.30870376 |
| CAS RN |
23044-80-6 |
| C_ID |
C00003643
, 
|
| InChIKey |
LQGNCUXDDPRDJH-AXMCSMRNNA-N |
| InChICode |
InChI=1S/C27H44O7/c1-14(2)6-7-22(32)26(5,33)21-8-9-27(34)16-11-17(28)15-10-18(29)19(30)12-24(15,3)23(16)20(31)13-25(21,27)4/h11,14-15,18-23,29-34H,6-10,12-13H2,1-5H3/t15-,18+,19-,20+,21-,22+,23+,24-,25+,26+,27+/m0/s1 |
| SMILES |
CC(C)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3[C@H](O)C[C@]12C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Animalia | Agelasidae | Agelas dispar | Ref. |
| Animalia | Zoanthidae | Zoanthus sp. | Ref. |
| Plantae | Asteraceae | Rhaponticum carthamoides  | Ref. |
| Plantae | Labiatae | Vitex madiensis | Ref. |
|
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