input word = C00023970

Metabolite InformationStructural formula
Name Arugosin D
1,12a-Dihydro-6,8-dihydroxy-1-(1-hydroxy-1-methylethyl)-4-methyl-9-(2-hydroxy-3-methylbut-3-enyl[1]benzopyrano[4,5-bc][1]benzoxepin-7(2H)-one
Formula C25H28O7
Mw 440.18350325
CAS RN 55826-58-9
C_ID C00023970 ,
InChIKey BBADAPVXQRFQDL-UHFFFAOYNA-N
InChICode InChI=1S/C25H28O7/c1-11(2)15(26)9-13-6-7-17-19(21(13)28)22(29)18-16(27)8-12(3)23-20(18)24(32-17)14(10-31-23)25(4,5)30/h6-8,14-15,24,26-28,30H,1,9-10H2,2-5H3/t14-,15+,24+/m0/s1
SMILES [C@H]12Oc3c(C(=O)c4c1c(c(cc4O)C)OC[C@@H]2C(C)(O)C)c(c(cc3)C[C@H](C(=C)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus variecolor Ref.
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