input word = C00016794

Metabolite InformationStructural formula
Name 15b beta-Hydroxy-N-acetylardeemine
Formula C28H28N4O4
Mw 484.21105541
CAS RN 148717-81-1
C_ID C00016794 ,
InChIKey UTVHCNQHDCRVMF-RGVWNYFINA-N
InChICode InChI=1S/C28H28N4O4/c1-6-26(4,5)27-15-28(36)24-29-20-13-9-7-11-18(20)23(35)30(24)16(2)22(34)32(28)25(27)31(17(3)33)21-14-10-8-12-19(21)27/h6-14,16,25,36H,1,15H2,2-5H3/t16-,25+,27-,28-/m1/s1
SMILES c1ccc2c(c1)[C@]1([C@@H](N2C(=O)C)N2[C@@](C1)(c1n([C@@H](C2=O)C)c(=O)c2c(n1)cccc2)O)C(C=C)(C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus fischeri var. brasiliensis Ref.
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OrganismAspergillus fischeri var. brasiliensis
ReferenceHochlowski,J.Antibiotics 46,(1993),380