input word = C00039990

Metabolite InformationStructural formula
Name Phenol A
Formula C11H16O3
Mw 196.10994438
CAS RN 79755-69-4
C_ID C00039990 ,
InChIKey ZYUVGYBAPZYKSA-BTBXXMRTNA-N
InChICode InChI=1S/C11H16O3/c1-6(8(3)12)10-4-9(13)5-11(14)7(10)2/h4-6,8,12-14H,1-3H3/t6-,8-/m1/s1
SMILES c1(cc(c(c(c1)[C@@H]([C@@H](C)O)C)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaePenicillium citrinum B-57u Ref.
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