input word = C00064023

Metabolite InformationStructural formula
Name Yunnanin C
Formula C36H47N7O9
Mw 721.34352615
CAS RN 173075-41-7
C_ID C00064023
InChIKey ZRVRAXPHBZFBBA-DGFLCFBESA-N
InChICode InChI=1S/C36H47N7O9/c1-3-21(2)31-35(51)38-18-29(46)39-25(16-22-8-5-4-6-9-22)32(48)40-26(17-23-11-13-24(45)14-12-23)33(49)41-27(20-44)36(52)43-15-7-10-28(43)34(50)37-19-30(47)42-31/h4-6,8-9,11-14,21,25-28,31,44-45H,3,7,10,15-20H2,1-2H3,(H,37,50)(H,38,51)(H,39,46)(H,40,48)(H,41,49)(H,42,47)/t21-,25-,26-,27-,28-,31-/m0/s1
SMILES CCC(C)C1NC(=O)CNC(=O)C2CCCN2C(=O)C(CO)NC(=O)C(Cc2ccc(O)cc2)NC(=O)C(Cc2ccccc2)NC(=O)CNC1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCaryophyllaceaeStellaria yunnanensis Ref.
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