input word = C00015695

Metabolite InformationStructural formula
Name Neobulgarone A
Formula C32H26O8
Mw 538.16276781
CAS RN 315209-15-5
C_ID C00015695 ,
InChIKey PQPFUPCNTQHJFA-UHFFFAOYNA-N
InChICode InChI=1S/C32H26O8/c1-13-5-17-25(19-9-15(33)11-21(35)27(19)31(37)29(17)23(7-13)39-3)26-18-6-14(2)8-24(40-4)30(18)32(38)28-20(26)10-16(34)12-22(28)36/h5-12,25-26,33-36H,1-4H3/t25-,26+
SMILES c12c(c(cc(c1)C)OC)C(=O)c1c([C@@H]2[C@H]2c3c(c(cc(c3)C)OC)C(=O)c3c2cc(cc3O)O)cc(cc1O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiLeotiaceaeNeobulgaria pura HA A07-97 Ref.
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OrganismNeobulgaria pura HA A07-97
ReferenceEilbert,J.Antibiotics 53,(2000),1123