input word =
C00011364
Metabolite Information
Structural 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
Fungi
Incertae sedis
Ascochyta heteromorpha
Ref.
Fungi
Incertae sedis
Phoma exigua var. exigua
Ref.
Fungi
Pleosporaceae
Pyrenophora semeniperda
Ref.
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