input word = C00011364

Metabolite InformationStructural formula
Name Deoxaphomin
Formula C29H37NO4
Mw 463.27225868
CAS RN 51053-39-5
C_ID C00011364 ,
InChIKey GPCJCBIEJCXNKC-IWOYMBTDNA-N
InChICode InChI=1S/C29H37NO4/c1-18-9-7-13-22(31)15-16-25(32)29-23(14-8-10-18)27(33)20(3)19(2)26(29)24(30-28(29)34)17-21-11-5-4-6-12-21/h4-6,8,11-12,14-16,18-19,22-24,26-27,31,33H,3,7,9-10,13,17H2,1-2H3,(H,30,34)/b14-8+,16-15+/t18-,19-,22+,23-,24+,26+,27-,29+/m1/s1
SMILES c1(C[C@@H]2NC(=O)[C@@]34[C@H]2[C@@H](C(=C)[C@H]([C@H]3/C=C/C[C@@H](CCC[C@@H](/C=C/C4=O)O)C)O)C)ccccc1
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Asp
Organism
Kingdom Family Species Reference
FungiIncertae sedisAscochyta heteromorpha Ref.
FungiIncertae sedisPhoma exigua var. exigua Ref.
FungiPleosporaceaePyrenophora semeniperda Ref.
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OrganismAscochyta heteromorpha
ReferenceCole,Handbook of Secondary Fungal Metabolites,Volume I,(2003)

Capasso,J.Nat.Prod.,50,(1987),989

Capasso,J.Nat.Prod.,51,(1988),567