| Name |
Macrocalyxin H |
| Formula |
C22H34O8 |
| Mw |
426.22536806 |
| CAS RN |
163658-55-7 |
| C_ID |
C00051401
|
| InChIKey |
DRPDKTMPBLAEQA-WPZQDALINA-N |
| InChICode |
InChI=1S/C22H34O8/c1-11(23)29-10-21(27)12-4-5-13-19-9-30-22(28,20(13,8-12)17(21)26)16(25)15(19)18(2,3)7-6-14(19)24/h12-17,24-28H,4-10H2,1-3H3/t12-,13+,14+,15-,16?,17+,19-,20+,21-,22-/m1/s1 |
| SMILES |
CC(=O)OC[C@@]1(O)[C@@H]2CC[C@H]3[C@@]45CO[C@](O)([C@@H](O)[C@@H]4C(C)(C)CC[C@@H]5O)[C@]3(C2)[C@@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Labiatae | Isodon macrocalyx | Ref. |
|
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