input word = C00050857

Metabolite InformationStructural formula
Name Isoagarotetrol
Formula C17H18O6
Mw 318.11033831
CAS RN 104060-61-9
C_ID C00050857
InChIKey CWMIROLCTHMEEO-LJHOVEDRNA-N
InChICode InChI=1S/C17H18O6/c18-11-8-10(7-6-9-4-2-1-3-5-9)23-17-12(11)13(19)14(20)15(21)16(17)22/h1-5,8,13-16,19-22H,6-7H2/t13-,14+,15-,16+/m0/s1
SMILES O=c1cc(CCc2ccccc2)oc2c1[C@H](O)[C@@H](O)[C@H](O)[C@H]2O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeThymelaeaceaeAquilaria agallocha Ref.
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