input word = C00053645

Metabolite InformationStructural formula
Name Peneciraistin C
Formula C19H26O9
Mw 398.15768243
CAS RN 1361031-80-2
C_ID C00053645
InChIKey MPVZXVXIZMIJFZ-NVBYNIPGSA-N
InChICode InChI=1S/C19H26O9/c1-9-5-6-15(26-10(2)20)19(28-9)17(27-11(3)21)12-7-14(22)18(4,24)16(23)13(12)8-25-19/h9,14-15,17,22,24H,5-8H2,1-4H3/t9-,14-,15-,17-,18+,19-/m0/s1
SMILES CC(=O)O[C@H]1CC[C@H](C)O[C@@]12OCC1=C(C[C@H](O)[C@@](C)(O)C1=O)[C@@H]2OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaePenicillium raistrickii HQ717799 Ref.
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