input word = C00025969

Metabolite InformationStructural formula
Name NPTX 12
Nephilatoxin 12
Formula C26H41N7O4
Mw 515.32200285
CAS RN 119613-55-7
C_ID C00025969 ,
InChIKey NTMZKPAKERWQCG-ANBDAQEENA-N
InChICode InChI=1S/C26H41N7O4/c27-11-4-7-12-29-15-10-24(35)30-13-5-1-6-14-31-26(37)22(17-23(28)34)33-25(36)16-19-18-32-21-9-3-2-8-20(19)21/h2-3,8-9,18,22,29,32H,1,4-7,10-17,27H2,(H2,28,34)(H,30,35)(H,31,37)(H,33,36)/t22-/m0/s1
SMILES NCCCCNCCC(=O)NCCCCCNC(=O)[C@H](CC(N)=O)NC(=O)Cc1c[nH]c2ccccc12
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
AnimaliaNephilidaeNephila clavata Ref.
zoom in