input word = C00015091

Metabolite InformationStructural formula
Name Oxasetin
Formula C21H29NO4
Mw 359.20965842
CAS RN 484675-06-1
C_ID C00015091 ,
InChIKey PGUSTONLIMHUIA-KARBHBCGNA-N
InChICode InChI=1S/C21H29NO4/c1-5-6-14-12(3)10-13-9-11(2)7-8-15(13)21(14,4)18(24)16-17(23)20(26)22-19(16)25/h10-11,13-15H,5-9H2,1-4H3,(H2,22,23,25,26)/t11-,13-,14-,15-,21+/m1/s1
SMILES [C@H]12[C@H](C[C@@H](CC1)C)C=C([C@H]([C@]2(C)C(=O)C1=C(C(=O)NC1=O)O)CCC)C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Arg Secologanin Cholesterol
Organism
Kingdom Family Species Reference
--Aquatica (HK1821) Ref.
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