input word = C00048318

Metabolite InformationStructural formula
Name Amarasterone A
Formula C29H48O7
Mw 508.34000389
CAS RN 20853-88-7
C_ID C00048318 ,
InChIKey GTRXMTZSWNWUAX-UHFFFAOYNA-N
InChICode InChI=1S/C29H48O7/c1-6-17(16(2)15-30)11-25(34)28(5,35)24-8-10-29(36)19-12-21(31)20-13-22(32)23(33)14-26(20,3)18(19)7-9-27(24,29)4/h12,16-18,20,22-25,30,32-36H,6-11,13-15H2,1-5H3/t16-,17+,18+,20+,22+,23+,24+,25-,26-,27-,28+,29-/m1/s1
SMILES CCC(CC(O)C(C)(O)C1CCC2(O)C3=CC(=O)C4CC(O)C(O)CC4(C)C3CCC12C)C(C)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAmaranthaceaeCyathula capitata Monquim-Tandon Ref.
PlantaeAsteraceaeRhaponticum carthamoides Ref.
zoom in



OrganismCyathula capitata Monquim-Tandon
ReferenceTakemoto,Tetrahedron Lett.,3191,(1967),5136

Hikino,Tetrahedron,26,(1970),887