input word = C00024970

Metabolite InformationStructural formula
Name Spiramadol
Formula C24H32O6
Mw 416.21988875
CAS RN 212968-32-6
C_ID C00024970 ,
InChIKey CFEHSRPMKSOGBC-GZYFOYOONA-N
InChICode InChI=1S/C24H32O6/c1-14-11-23-9-6-17(14)10-18(23)24(13-26)8-5-7-22(4,12-25)20(24)19(29-15(2)27)21(23)30-16(3)28/h12-13,17-21H,1,5-11H2,2-4H3/t17-,18+,19-,20+,21+,22-,23+,24+/m0/s1
SMILES C1[C@]23[C@@H]([C@H]([C@@H]4[C@@](CCC[C@]4([C@@H]2C[C@@H](C(=C)C3)C1)C=O)(C=O)C)OC(=O)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRosaceaeSpiraea japonica var.acuta Ref.
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