| Name |
Spicatolignan A |
| Formula |
C27H30O13 |
| Mw |
562.16864105 |
| CAS RN |
1010821-33-6 |
| C_ID |
C00057739
|
| InChIKey |
VDVOWFVOUZSNJT-RSWFLHIQSA-N |
| InChICode |
InChI=1S/C27H30O13/c1-35-16-8-13(9-17(36-2)21(16)31)25-15(11-38-27-24(34)23(33)22(32)19(10-28)39-27)14-6-12(4-5-20(29)30)7-18(37-3)26(14)40-25/h4-9,19,22-24,27-28,31-34H,10-11H2,1-3H3,(H,29,30)/b5-4+/t19-,22-,23+,24-,27-/m1/s1 |
| SMILES |
COc1cc(-c2oc3c(OC)cc(/C=C/C(=O)O)cc3c2CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Labiatae | Mentha spicata  | Ref. |
|
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