input word = C00038478

Metabolite InformationStructural formula
Name Aplysinoplide A
(-)-Aplysinoplide A
Formula C25H36O4
Mw 400.26135964
CAS RN 1038397-16-8
C_ID C00038478 ,
InChIKey IXZLFRIHNOJYGA-QGBXNASSNA-N
InChICode InChI=1S/C25H36O4/c1-18(13-14-22-19(2)9-7-15-25(22,3)4)8-5-10-20(17-26)11-6-12-21-16-23(27)29-24(21)28/h6,8,11-12,16,24,26,28H,5,7,9-10,13-15,17H2,1-4H3/b12-6+,18-8+,20-11+/t24-/m1/s1
SMILES CC1=C(CC/C(C)=C/CC/C(=CC=CC2=CC(=O)OC2O)CO)C(C)(C)CCC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaThorectidaeAplysinopsis digitata Ref.
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