input word = C00000873

Metabolite InformationStructural formula
Name Aphidicolin
Aphidicolane-3alpha,16,17,18-tetraol
Formula C20H34O4
Mw 338.24570957
CAS RN 38966-21-1
C_ID C00000873 ,
InChIKey NOFOAYPPHIUXJR-SSBDWBTFNA-N
InChICode InChI=1S/C20H34O4/c1-17(11-21)15-4-3-13-9-14-10-19(13,7-8-20(14,24)12-22)18(15,2)6-5-16(17)23/h13-16,21-24H,3-12H2,1-2H3/t13-,14+,15-,16+,17-,18-,19-,20-/m0/s1
SMILES C[C@@]1(CO)[C@H](O)CC[C@@]2(C)[C@H]1CC[C@H]1C[C@H]3C[C@@]12CC[C@]3(O)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Cephalosporium aphidicola Ref.
--Harziella entomophilla Ref.
--Nigrospora sphaerica Ref.
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OrganismNigrospora sphaerica
ReferenceBrundret,J.C.S.Chem.Commun.,(1972),1027-1028

Dalziel,J.Chem.Soc.,Perkin Trans.,1,(1973),2841-2851

Kawada,Agric.Biol.Chem.,42,(1978),1611-1612

Starrat,Canad.J.Microbiol.,20,(1974),416-417