input word = C00027095

Metabolite InformationStructural formula
Name Quaternine
Formula C23H28N2O5
Mw 412.19982202
CAS RN 57499-02-2
C_ID C00027095 ,
InChIKey IMTNXQPCOHYKEO-FRAHAVLQNA-N
InChICode InChI=1S/C23H28N2O5/c1-6-12-11-25-18-7-13(12)20(21(26)29-5)22-10-19(25)30-23(18,22)24(2)15-9-17(28-4)16(27-3)8-14(15)22/h6,8-9,13,18-20H,7,10-11H2,1-5H3/b12-6-/t13-,18-,19-,20-,22-,23-/m0/s1
SMILES [C@@]123O[C@@H]4N5[C@H]3C[C@@H](/C(=C\C)/C5)[C@H]([C@@]2(c2c(cc(c(c2)OC)OC)N1C)C4)C(=O)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeAlstonia macrophylla Ref.
PlantaeApocynaceaeAlstonia quaternata Ref.
PlantaeApocynaceaeRauvolfia vomitoria Ref.
zoom in



OrganismAlstonia quaternata
ReferenceChinese Materia Medica Editing Committee of the National Chinese Medicine and Pharmacology Bureau, Chinese Materia Medica (ZHONG HUA BEN CAO), Vol.1-Vol.30, Shanghai Science and technology Press, Shanghai, (1999).

Buckingham(Executive Editor), Dictionary of Natural Products, Chapman & Hall, 1994, Vol1-7

1995, Vol8

1996, Vol9

1997, Vol10

1998, Vol11

Mamatos,Phytochem.,14,(1975),1489