input word = C00048902

Metabolite InformationStructural formula
Name Xenimanadin A
(-)-Xenimanadin A
Formula C23H36O5
Mw 392.25627426
CAS RN 1025022-58-5
C_ID C00048902 ,
InChIKey ITJGGQBNZBMBLH-JMNPGSAMNA-N
InChICode InChI=1S/C23H36O5/c1-15-10-11-18-19(9-8-12-23(3,4)27-7)21(25-5)28-22(26-6)20(18)16(2)14-17(24)13-15/h8-9,12-13,17-18,20-22,24H,2,10-11,14H2,1,3-7H3/b12-8+,15-13-,19-9-/t17-,18+,20-,21-,22-/m0/s1
SMILES C=C1C[C@@H](O)/C=C(/C)CC[C@@H]2/C(=C/C=C/C(C)(C)OC)[C@@H](OC)O[C@H](OC)[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePortulacaceae/XeniidaeXenia sp. Ref.
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