input word = C00058540

Metabolite InformationStructural formula
Name Javanicin W
Formula C20H30O7
Mw 382.19915331
CAS RN 138843-02-4
C_ID C00058540
InChIKey FQRVCNACRZPBIN-VLCCXMQRSA-N
InChICode InChI=1S/C20H30O7/c1-9-15(26-4)14(23)16-18(2)10(5-6-11(21)17(18)24)7-12-19(16,3)20(9,25)8-13(22)27-12/h9-12,14-16,21,23,25H,5-8H2,1-4H3/t9-,10+,11-,12+,14+,15-,16+,18-,19+,20+/m0/s1
SMILES CO[C@@H]1[C@@H](O)[C@@H]2[C@@]3(C)C(=O)[C@@H](O)CC[C@@H]3C[C@H]3OC(=O)C[C@@](O)([C@H]1C)[C@@]23C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSimaroubaceaePicrasma javanica Ref.
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OrganismPicrasma javanica
ReferenceK. Koike et al., Chem. Abs., (1991), 116, 80437.