input word = C00044596

Metabolite InformationStructural formula
Name Buceracidin A
(+)-Buceracidin A
Formula C21H20O6
Mw 368.12598837
CAS RN 485831-90-1
C_ID C00044596 ,
InChIKey SHVNMDGYHQHAIC-MYKRFBFLNA-N
InChICode InChI=1S/C21H20O6/c1-21(2)9-8-12-14(27-21)10-15-16(17(12)23)18(24)20(25-3)19(26-15)11-6-4-5-7-13(11)22/h4-10,19-20,22-23H,1-3H3/t19-,20+/m1/s1
SMILES CO[C@H]1C(=O)c2c(cc3c(c2O)C=CC(C)(C)O3)O[C@@H]1c1ccccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCombretaceaeBucida buceras Ref.
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