input word = C00036172

Metabolite InformationStructural formula
Name Neoglabrescin A
Formula C17H24O7
Mw 340.15220312
CAS RN 625823-63-4
C_ID C00036172 ,
InChIKey ABPUYEWDDXGKKH-KWHDXDGJNA-N
InChICode InChI=1S/C17H24O7/c1-7-3-11-16(23)8(2)4-9(19)5-10(16)13-15(22,6-18)14(21)17(11,24-13)12(7)20/h3,8,10-14,18,20-23H,4-6H2,1-2H3/t8-,10-,11+,12+,13-,14-,15-,16-,17-/m1/s1
SMILES [C@@]12([C@@H]([C@@H]3[C@@]([C@H]([C@]4([C@H]1C=C([C@@H]4O)C)O3)O)(CO)O)CC(=O)C[C@H]2C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeNeoboutonia glabrescens Prain Ref.
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OrganismNeoboutonia glabrescens Prain
ReferenceTchinda,Phytochem.,64,(2003),575