input word = C00023904

Metabolite InformationStructural formula
Name Helvolic acid
Fumigacin
Formula C33H44O8
Mw 568.30361838
CAS RN 29400-42-8
C_ID C00023904 ,
InChIKey MDFZYGLOIJNNRM-UOABJHMYNA-N
InChICode InChI=1S/C33H44O8/c1-17(2)10-9-11-21(30(38)39)26-22-12-13-25-31(6)15-14-23(36)18(3)27(31)28(41-20(5)35)29(37)33(25,8)32(22,7)16-24(26)40-19(4)34/h10,14-15,18,22,24-25,27-28H,9,11-13,16H2,1-8H3,(H,38,39)/b26-21-/t18-,22+,24+,25+,27-,28+,31-,32+,33-/m1/s1
SMILES C1=C[C@]2([C@H]([C@@H](C1=O)C)[C@@H](C(=O)[C@]1([C@H]2CC[C@@H]2[C@@]1(C[C@@H](/C/2=C(/CCC=C(C)C)\C(=O)O)OC(=O)C)C)C)OC(=O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiIncertae sedisEmericellopsis terricola Ref.
FungiTrichocomaceaeAspergillus fumigatus Ref.
FungiTrichocomaceaeAspergillus sydowi PFW1-13 Ref.
--Cephalosporium caerulens Ref.
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