input word = C00033628

Metabolite InformationStructural formula
Name Alisolide
Formula C26H36O4
Mw 412.26135964
CAS RN 1005191-17-2
C_ID C00033628 ,
InChIKey TUVXZFRJBJGPCX-AKFJQUAGNA-N
InChICode InChI=1S/C26H36O4/c1-15-13-20(29)30-26(15)12-11-24(5)18(26)14-16(27)21-23(4)9-8-19(28)22(2,3)17(23)7-10-25(21,24)6/h14-15,17,21H,7-13H2,1-6H3/t15-,17+,21+,23+,24+,25+,26+/m1/s1
SMILES C1C(=O)C([C@H]2[C@](C1)([C@H]1[C@](CC2)([C@@]2(C(=CC1=O)[C@@]1(CC2)OC(=O)C[C@H]1C)C)C)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAlismataceaeAlisma orientale Ref.
zoom in