input word = C00000633

Metabolite InformationStructural formula
Name Acoradin
Formula C24H32O6
Mw 416.21988875
CAS RN 73036-51-8
C_ID C00000633 ,
InChIKey WCERJEZPIONOJU-UHFFFAOYNA-N
InChICode InChI=1S/C24H32O6/c1-13-14(2)24(16-10-20(28-6)22(30-8)12-18(16)26-4)23(13)15-9-19(27-5)21(29-7)11-17(15)25-3/h9-14,23-24H,1-8H3/t13-,14+,23-,24-/m1/s1
SMILES c1c(c(cc(c1OC)[C@@H]1[C@H]([C@@H]([C@@H]1C)C)c1cc(c(cc1OC)OC)OC)OC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcoraceaeAcorus calamus Ref.
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