input word = C00041072

Metabolite InformationStructural formula
Name Niloticin
Formula C30H48O3
Mw 456.3603454
CAS RN 115404-57-4
C_ID C00041072 ,
InChIKey GKQMMZUXYRXFOH-STCZKDHYNA-N
InChICode InChI=1S/C30H48O3/c1-18(17-22(31)25-27(4,5)33-25)19-11-15-30(8)21-9-10-23-26(2,3)24(32)13-14-28(23,6)20(21)12-16-29(19,30)7/h9,18-20,22-23,25,31H,10-17H2,1-8H3/t18-,19-,20-,22+,23-,25-,28+,29-,30+/m0/s1
SMILES C1C(=O)C([C@H]2[C@](C1)([C@@H]1C(=CC2)[C@@]2([C@@](CC1)([C@@H](CC2)[C@@H](C)C[C@H]([C@H]1C(O1)(C)C)O)C)C)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeAglaia leucophylla Ref.
PlantaeMeliaceaeDysoxylum variabile Ref.
PlantaeMeliaceaeTurraea nilotica Ref.
PlantaeRutaceaePhellodendron amurense Ref.
PlantaeRutaceaePhellodendron chinense Ref.
PlantaeSimaroubaceaeCastela polyandra Ref.
PlantaeSimaroubaceaeEurycoma longifolia Ref.
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OrganismDysoxylum variabile
ReferenceLiu,J.Nat.Prod.,64,(2001),159