input word = C00039884

Metabolite InformationStructural formula
Name Nuttingin A
Formula C27H40N4O3
Mw 468.31004117
CAS RN 945458-41-3
C_ID C00039884 ,
InChIKey SNMBJCGYFMKJRR-YIZVWSOXSA-N
InChICode InChI=1S/C27H40N4O3/c1-19(2)16-23(32)17-22(5)13-9-11-20(3)10-8-12-21(4)14-15-31-18-28-25-24(31)26(33)30(7)27(34)29(25)6/h10,13-14,18-19H,8-9,11-12,15-17H2,1-7H3/b20-10+,21-14+,22-13+
SMILES c1(=O)n(c(=O)c2c(n1C)ncn2C/C=C(/CC/C=C(/CC/C=C(/CC(=O)CC(C)C)\C)\C)\C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys
Organism
Kingdom Family Species Reference
--Euplexaura nuttingi Ref.
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