input word = C00037553

Metabolite InformationStructural formula
Name Ningposide B
Formula C18H22O9
Mw 382.1263823
CAS RN 307318-00-9
C_ID C00037553 ,
InChIKey BCCVUXNXLHXLEU-LGHOEBSXNA-N
InChICode InChI=1S/C18H22O9/c1-9-16(26-10(2)19)15(22)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 COc1cc(/C=C/C(=O)O[C@@H]2[C@H](O)[C@@H](OC(C)=O)[C@H](C)O[C@H]2O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeScrophulariaceaeScrophularia ningpoensis Ref.
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