input word = C00038292

Metabolite InformationStructural formula
Name 5'-Hydroxymonocillin III
Formula C18H20O7
Mw 348.12090299
CAS RN 1004540-69-5
C_ID C00038292 ,
InChIKey PDABOOGSLAXXJV-SPTGQDIZNA-N
InChICode InChI=1S/C18H20O7/c1-9-4-15-16(25-15)8-12(20)3-2-11(19)5-10-6-13(21)7-14(22)17(10)18(23)24-9/h2-3,6-7,9,12,15-16,20-22H,4-5,8H2,1H3/b3-2+/t9-,12-,15-,16-/m1/s1
SMILES c12c(CC(=O)/C=C/[C@H](C[C@@H]3[C@@H](C[C@H](OC1=O)C)O3)O)cc(cc2O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiMontagnulaceaeParaphaeosphaeria quadriseptata Ref.
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