input word = C00039888

Metabolite InformationStructural formula
Name Nuttingin E
Formula C27H42N4O2
Mw 454.33077661
CAS RN 945458-45-7
C_ID C00039888 ,
InChIKey VVFKJCSQWFALCI-FGVXUPOYSA-N
InChICode InChI=1S/C27H42N4O2/c1-20(2)16-24(32)17-23(5)13-9-11-21(3)10-8-12-22(4)14-15-31-18-28-26-25(31)27(33)30(7)19-29(26)6/h10,14,17-18,20H,8-9,11-13,15-16,19H2,1-7H3/b21-10+,22-14+,23-17-
SMILES C1N(C(=O)c2c(N1C)ncn2C/C=C(/CC/C=C(/CCC/C(=C\C(=O)CC(C)C)/C)\C)\C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Asp
Organism
Kingdom Family Species Reference
--Euplexaura nuttingi Ref.
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