input word = C00054941

Metabolite InformationStructural formula
Name Citrusin V
Formula C27H46N6O7
Mw 566.34279787
CAS RN 425408-71-5
C_ID C00054941
InChIKey AGPIOXWTGKGPPK-HVAMYJMISA-N
InChICode InChI=1S/C27H46N6O7/c1-14(2)10-17-24(37)32-22(16(5)6)26(39)30-18(11-15(3)4)27(40)33-9-7-8-20(33)25(38)31-19(13-34)23(36)28-12-21(35)29-17/h14-20,22,34H,7-13H2,1-6H3,(H,28,36)(H,29,35)(H,30,39)(H,31,38)(H,32,37)/t17-,18-,19-,20-,22-/m0/s1
SMILES CC(C)C[C@@H]1NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)[C@H](C(C)C)NC1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCitrus aurantium Ref.
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