input word = C00019805

Metabolite InformationStructural formula
Name Buntansin C
Formula C16H18O7
Mw 322.10525293
CAS RN 156250-66-7
C_ID C00019805 ,
InChIKey WHMUEJXPAUEKOX-DUXBJXIBNA-N
InChICode InChI=1S/C16H18O7/c1-16(2,21)15(20)14(19)13(18)9-6-8-4-5-12(17)23-10(8)7-11(9)22-3/h4-7,13-14,18-19,21H,1-3H3/t13-,14+/m0/s1
SMILES c1(c(cc2c(c1)oc(=O)cc2)[C@H](O)[C@H](C(=O)C(O)(C)C)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCitrus grandis buntan Ref.
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