input word = C00019774

Metabolite InformationStructural formula
Name Acrimarine B
Formula C31H29NO8
Mw 543.18931691
CAS RN 119152-48-6
C_ID C00019774 ,
InChIKey GYFLCSOBRHGLCZ-UHFFFAOYNA-N
InChICode InChI=1S/C31H29NO8/c1-15(2)11-19(18-12-16-7-10-25(33)40-22(16)14-23(18)37-4)26-24(38-5)13-20-27(30(26)35)29(34)17-8-9-21(36-3)31(39-6)28(17)32-20/h7-14,19,35H,1-6H3,(H,32,34)/t19-/m1/s1
SMILES c1c(c(c2c(c1)c(=O)c1c([nH]2)cc(c(c1O)[C@@H](c1c(cc2c(c1)ccc(=O)o2)OC)C=C(C)C)OC)OC)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCitrus funadoko Ref.
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