input word = C00015697

Metabolite InformationStructural formula
Name Neobulgarone C
Formula C32H25ClO8
Mw 572.12379549
CAS RN 315209-17-7
C_ID C00015697 ,
InChIKey XTZHVTOVVQVQKP-UHFFFAOYNA-N
InChICode InChI=1S/C32H25ClO8/c1-12-5-15-23(17-9-14(34)10-18(35)24(17)31(38)25(15)21(7-12)40-3)27-16-6-13(2)8-22(41-4)26(16)32(39)28-19(36)11-20(37)30(33)29(27)28/h5-11,23,27,34-37H,1-4H3/t23-,27-/m0/s1
SMILES COc1cc(C)cc2c1C(=O)c1c(O)cc(O)cc1C2C1c2cc(C)cc(OC)c2C(=O)c2c(O)cc(O)c(Cl)c21
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