input word = C00028874

Metabolite InformationStructural formula
Name Pseudostellarin A
Formula C25H35N5O6
Mw 501.25873389
CAS RN 156430-20-5
C_ID C00028874 ,
InChIKey DXLCLVHVNXYTJQ-RIHMWAHENA-N
InChICode InChI=1S/C25H35N5O6/c1-4-14(2)21-25(36)27-15(3)22(33)26-13-20(32)30-11-5-6-19(30)24(35)28-18(23(34)29-21)12-16-7-9-17(31)10-8-16/h7-10,14-15,18-19,21,31H,4-6,11-13H2,1-3H3,(H,26,33)(H,27,36)(H,28,35)(H,29,34)/t14-,15+,18+,19+,21+/m1/s1
SMILES CCC(C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H]2CCCN2C(=O)CNC(=O)[C@H](C)NC1=O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys
Organism
Kingdom Family Species Reference
PlantaeCaryophyllaceaePseudostellaria heterophylla Ref.
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