input word = C00018489

Metabolite InformationStructural formula
Name Ansatrienin A2
Formula C34H46N2O8
Mw 610.32541646
CAS RN 85819-32-5
C_ID C00018489 ,
InChIKey JFTBOCROFWRVMA-MINZKMQENA-N
InChICode InChI=1S/C34H46N2O8/c1-7-21(2)33(41)35-24(5)34(42)44-29-17-12-10-8-9-11-16-27(43-6)20-30(38)36-28-19-26(37)18-25(32(28)40)15-13-14-22(3)31(39)23(29)4/h8-12,14,16,18-19,21,23-24,27,29,31,39H,7,13,15,17,20H2,1-6H3,(H,35,41)(H,36,38)/b9-8+,12-10-,16-11+,22-14+/t21-,23+,24-,27-,29-,31-/m0/s1
SMILES N1C2=CC(=O)C=C(CC/C=C(/[C@@H]([C@@H]([C@H](C/C=C\C=C\C=C\[C@@H](CC1=O)OC)OC(=O)[C@H](C)NC(=O)[C@@H](C)CC)C)O)\C)C2=O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces collinus Ref.
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OrganismStreptomyces collinus
ReferenceLazar,J. Antibiotics,36,(1983),187