input word = C00055466

Metabolite InformationStructural formula
Name Cycloreticulin C
Formula C36H50N8O9
Mw 738.37007525
CAS RN 1105703-78-3
C_ID C00055466
InChIKey JPOCRGHRLGVHLD-CJQGIMJOSA-N
InChICode InChI=1S/C36H50N8O9/c1-20(2)30-36(53)43-16-3-6-25(43)32(49)38-19-29(47)39-23(13-14-28(37)46)34(51)44-17-5-8-27(44)35(52)42-15-4-7-26(42)33(50)40-24(31(48)41-30)18-21-9-11-22(45)12-10-21/h9-12,20,23-27,30,45H,3-8,13-19H2,1-2H3,(H2,37,46)(H,38,49)(H,39,47)(H,40,50)(H,41,48)/t23-,24-,25-,26-,27-,30-/m0/s1
SMILES CC(C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H]2CCCN2C1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAnnona reticulata Ref.
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