input word = C00016923

Metabolite InformationStructural formula
Name Isochromophilone I
Formula C23H25ClO5
Mw 416.13905162
CAS RN 219823-02-7
C_ID C00016923 ,
InChIKey BFKHRJFETIBYAU-VCMWWNDINA-N
InChICode InChI=1S/C23H25ClO5/c1-6-12(2)9-13(3)7-8-15-10-16-17(11-28-15)19-18(14(4)25)22(27)29-23(19,5)21(26)20(16)24/h7-12,18-19H,6H2,1-5H3/b8-7+,13-9+/t12-,18-,19-,23+/m0/s1
SMILES C1=C2C(=C(C(=O)[C@]3([C@@H]2[C@@H](C(=O)O3)C(=O)C)C)Cl)C=C(O1)/C=C/C(=C/[C@H](CC)C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaePenicillium multicolor FO-2338 Ref.
FungiTrichocomaceaePenicillium sp. FO-2338 Ref.
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OrganismPenicillium multicolor FO-2338
ReferenceGao, J-M. et al., Chem. Rev., 113, (2013), 4755-4811.