input word = C00047701

Metabolite InformationStructural formula
Name Ailanquassin A
(+)-Ailanquassin A
Formula C19H24O7
Mw 364.15220312
CAS RN 159903-52-3
C_ID C00047701 ,
InChIKey QFFKFFIFIWKYEB-VKUSFAPYNA-N
InChICode InChI=1S/C19H24O7/c1-8-4-12(20)26-15(8)17(3)6-11-18-7-24-19(23,16(17)18)14(22)9(2)10(18)5-13(21)25-11/h4,9-11,14-16,22-23H,5-7H2,1-3H3/t9-,10+,11-,14-,15+,16-,17-,18-,19+/m1/s1
SMILES CC1=CC(=O)O[C@@H]1[C@@]1(C)C[C@H]2OC(=O)C[C@H]3[C@@H](C)[C@@H](O)[C@]4(O)OC[C@]23[C@@H]14
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSimaroubaceaeAilanthus malabarica Ref.
PlantaeSimaroubaceaeEurycoma longifolia Ref.
--Simba cedron Ref.
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