input word = C00043813

Metabolite InformationStructural formula
Name Phomacin A
(-)-Phomacin A
Formula C25H37NO5
Mw 431.2671733
CAS RN 187847-10-5
C_ID C00043813 ,
InChIKey CTCWWHNYPVOMQP-SEIIMQNTNA-N
InChICode InChI=1S/C25H37NO5/c1-13(2)9-19-22-17(6)15(4)12-18-11-14(3)10-16(5)23(29)20(27)7-8-21(28)31-25(18,22)24(30)26-19/h7-8,11-13,16-20,22-23,27,29H,9-10H2,1-6H3,(H,26,30)/b8-7+,14-11+/t16-,17+,18-,19-,20+,22-,23-,25+/m0/s1
SMILES CC1=C[C@@H]2/C=C(C)C[C@H](C)[C@H](O)[C@H](O)/C=C/C(=O)O[C@]23C(=O)N[C@@H](CC(C)C)[C@@H]3[C@@H]1C
Start Substs in Alk. Biosynthesis (Prediction) L-Lys L-Arg L-Asp
Organism
Kingdom Family Species Reference
FungiIncertae sedisPhoma sp. Ref.
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