input word = C00042741

Metabolite InformationStructural formula
Name Microclavatin
(-)-Microclavatin
Formula C20H28O3
Mw 316.20384476
CAS RN 860639-16-3
C_ID C00042741 ,
InChIKey XMAKUNDAGAVHGP-AIUJAAMXNA-N
InChICode InChI=1S/C20H28O3/c1-12-6-7-14-15(19(14,3)4)11-13(2)16(21)8-9-20(5)18(23-20)17(22)10-12/h8-9,11-12,14-15,18H,6-7,10H2,1-5H3/b9-8-,13-11+/t12-,14-,15+,18+,20+/m0/s1
SMILES [C@H]12CC[C@@H](CC(=O)[C@H]3O[C@@]3(/C=C\C(=O)/C(=C/[C@H]1C2(C)C)/C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Sinularia microclavata Ref.
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