input word = C00037552

Metabolite InformationStructural formula
Name Ningposide A
Formula C18H22O9
Mw 382.1263823
CAS RN 254453-79-7
C_ID C00037552 ,
InChIKey NIFRPWXJGCHSOO-JASPOFLDNA-N
InChICode InChI=1S/C18H22O9/c1-9-15(22)16(26-10(2)19)17(18(23)25-9)27-14(21)7-5-11-4-6-12(20)13(8-11)24-3/h4-9,15-18,20,22-23H,1-3H3/b7-5+/t9-,15-,16+,17+,18+/m0/s1
SMILES c1(ccc(cc1OC)/C=C/C(=O)O[C@@H]1[C@@H]([C@H]([C@@H](O[C@H]1O)C)O)OC(=O)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeScrophulariaceaeScrophularia ningpoensis Ref.
zoom in