| Name |
Neobignonoside |
| Formula |
C28H24O13 |
| Mw |
568.12169086 |
| CAS RN |
198063-83-1 |
| C_ID |
C00057212
|
| InChIKey |
CXIQAQPRRCDWSI-HOZVGSINSA-N |
| InChICode |
InChI=1S/C28H24O13/c29-13-3-1-12(2-4-13)27(37)38-11-22-24(34)25(35)26(36)28(41-22)39-15-8-18(32)23-19(33)10-20(40-21(23)9-15)16-6-5-14(30)7-17(16)31/h1-10,22,24-26,28-32,34-36H,11H2/t22-,24-,25+,26-,28-/m1/s1 |
| SMILES |
O=C(OC[C@H]1O[C@@H](Oc2cc(O)c3c(=O)cc(-c4ccc(O)cc4O)oc3c2)[C@H](O)[C@@H](O)[C@@H]1O)c1ccc(O)cc1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Labiatae | Vitex agnus-castus  | Ref. |
|
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