input word = C00026676

Metabolite InformationStructural formula
Name (+)-Milnamide A
(3S)-(+)-Milnamide A
(3S)-Milnamide A
Milnamide A
Formula C31H46N4O4
Mw 538.35190599
CAS RN 156430-97-6
C_ID C00026676 ,
InChIKey DTDKDYCVVOKSAV-PLPXLAKPNA-N
InChICode InChI=1S/C31H46N4O4/c1-18(2)22(16-19(3)29(38)39)35(11)28(37)25(30(4,5)6)32-27(36)26-31(7,8)24-20-14-12-13-15-21(20)34(10)23(24)17-33(26)9/h12-16,18,22,25-26H,17H2,1-11H3,(H,32,36)(H,38,39)/b19-16+/t22-,25-,26-/m1/s1
SMILES c12c(c3c(n1C)CN([C@@H](C3(C)C)C(=O)N[C@@H](C(C)(C)C)C(=O)N(C)[C@@H](C(C)C)/C=C(\C)/C(=O)O)C)cccc2
Start Substs in Alk. Biosynthesis (Prediction) Anthranilate L-His
Organism
Kingdom Family Species Reference
AnimaliaDemospongiaeAuletta cf.constricta Ref.
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