input word = C00031319

Metabolite InformationStructural formula
Name Scillascillin
Formula C17H12O6
Mw 312.06338812
CAS RN 52706-07-7
C_ID C00031319 ,
InChIKey SAXOGBBWXWKZKR-AGDOHHJYNA-N
InChICode InChI=1S/C17H12O6/c18-9-2-11(19)15-14(3-9)21-6-17(16(15)20)5-8-1-12-13(4-10(8)17)23-7-22-12/h1-4,18-19H,5-7H2/t17-/m0/s1
SMILES O=C1c2c(O)cc(O)cc2OC[C@]12Cc1cc3c(cc12)OCO3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHyacinthaceaeScilla scilloides DRUCE Ref.
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