input word = C00021246

Metabolite InformationStructural formula
Name Epipolasinthiourea B
Formula C24H36N2S
Mw 384.25991989
CAS RN 97915-90-7
C_ID C00021246 ,
InChIKey RRMDKPQBIRMMQD-XYOBVNTBNA-N
InChICode InChI=1S/C24H36N2S/c1-16-10-11-18-20(16)21-19(23(21,2)3)12-14-24(18,4)26-22(27)25-15-13-17-8-6-5-7-9-17/h5-9,16,18-21H,10-15H2,1-4H3,(H2,25,26,27)/t16-,18-,19-,20+,21-,24-/m0/s1
SMILES C1C[C@H]2[C@@H]([C@H]1C)[C@@H]1[C@H](CC[C@]2(C)NC(=S)NCCc2ccccc2)C1(C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Asp L-His
Organism
Kingdom Family Species Reference
AnimaliaHalichondriidaeEpipolasis kushimotoensis Ref.
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