input word = C00039988

Metabolite InformationStructural formula
Name Phelligridin I
Formula C33H20O13
Mw 624.09039073
CAS RN 935684-28-9
C_ID C00039988 ,
InChIKey ZNLSHKJBXWCRKW-CLLRDSTBSA-N
InChICode InChI=1S/C33H20O13/c34-21-6-2-14(7-22(21)35)1-4-16-9-27(40)29(32(42)44-16)18-11-24(37)23(36)8-15(18)3-5-17-10-28-30(33(43)45-17)19-12-25(38)26(39)13-20(19)31(41)46-28/h1-13,34-40H/b4-1+,5-3+
SMILES O=c1oc(/C=C/c2ccc(O)c(O)c2)cc(O)c1-c1cc(O)c(O)cc1/C=C/c1cc2oc(=O)c3cc(O)c(O)cc3c2c(=O)o1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiHymenochaetaceaePhellinus igniarius Ref.
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