input word = C00043320

Metabolite InformationStructural formula
Name Boneratamide B methyl ester
(+)-Boneratamide B methyl ester
Formula C24H38N2O4
Mw 418.28315772
CAS RN 786699-05-6
C_ID C00043320 ,
InChIKey DHBZMBYIJDLUIZ-TYRVVHHZNA-N
InChICode InChI=1S/C24H38N2O4/c1-14(2)18-8-7-16(4)24(12-11-15(3)13-24)21(18)25-22(28)17(5)26-19(23(29)30-6)9-10-20(26)27/h13-14,16-19,21H,7-12H2,1-6H3,(H,25,28)/t16-,17+,18+,19-,21-,24-/m1/s1
SMILES C1[C@H]([C@@]2([C@@H]([C@@H](C1)C(C)C)NC(=O)[C@@H](N1C(=O)CC[C@@H]1C(=O)OC)C)CCC(=C2)C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Arg
Organism
Kingdom Family Species Reference
AnimaliaDemospongiaeAxinyssa aplysinoides Ref.
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OrganismAxinyssa aplysinoides
ReferenceWilliams,J.Nat.Prod.,67,(2004),1752