input word = C00026696

Metabolite InformationStructural formula
Name Scytonine
Formula C31H22N2O6
Mw 518.14778645
CAS RN 683771-38-2
C_ID C00026696 ,
InChIKey RBULROHCVWCNGA-HMMYKYKNSA-N
InChICode InChI=1S/C31H22N2O6/c1-38-30(36)20(15-16-11-13-17(34)14-12-16)27-23(18-7-3-5-9-21(18)32-27)25-26(31(37)39-2)24-19-8-4-6-10-22(19)33-28(24)29(25)35/h3-15,32-34H,1-2H3/b20-15+
SMILES c12c(cccc1)[nH]c1c2C(=C(C1=O)c1c(/C(=C\c2ccc(cc2)O)/C(=O)OC)[nH]c2c1cccc2)C(=O)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
BacteriaScytonemataceaeScytonema sp. Ref.
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