input word = C00047094

Metabolite InformationStructural formula
Name Speranculatine B
(+)-Speranculatine B
Formula C20H24N2O10
Mw 452.143095
CAS RN 268728-60-5
C_ID C00047094 ,
InChIKey XPTWLIFSBXWZNJ-BGYRXZFFNA-N
InChICode InChI=1S/C20H24N2O10/c1-9(23)7-19(29)13(31-5)11(15(25)21(3)17(19)27)12-14(32-6)20(30,8-10(2)24)18(28)22(4)16(12)26/h29-30H,7-8H2,1-6H3/t19-,20+
SMILES C1(=C([C@](C(=O)N(C1=O)C)(CC(=O)C)O)OC)C1=C([C@@](C(=O)N(C1=O)C)(CC(=O)C)O)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Ala
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeSperanskia tuberculata Ref.
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OrganismSperanskia tuberculata
ReferenceShi,J.Nat.Prod.,63,(2000),782