16-epi-Vellosimine
product of hydrolysis of Polyneuridine aldehyde by Polyneuridine-aldehyde esterase
General
Type : Alkaloid
Chemical_Nomenclature : 16-epi-Vellosimine
Canonical SMILES : CCC1CN2C3CC1C(C2CC4=C3NC5=CC=CC=C45)C(=O)O
InChI : InChI=1S\/C19H22N2O2\/c1-2-10-9-21-15-8-13-11-5-3-4-6-14(11)20-18(13)16(21)7-12(10)17(15)19(22)23\/h3-6,10,12,15-17,20H,2,7-9H2,1H3,(H,22,23)\/t10?,12-,15-,16-,17-\/m0\/s1
InChIKey : GXPDJZPKLCZSLD-MZXXMQOISA-N
Other name(s) : EVS
MW : 310.39
Formula : C19H22N2O2
CAS_number :
PubChem : 44144387
UniChem : GXPDJZPKLCZSLD-MZXXMQOISA-N
IUPHAR :
Wikipedia :
Target
Families : 16-epi-Vellosimine ligand of proteins in family: Hydroxynitrile_lyase
Stucture : 3GZJ Crystal Structure of Polyneuridine Aldehyde Esterase Complexed with 16-epi-Vellosimine
Protein : rause-pnae
References (1)
| Title : Structural basis and enzymatic mechanism of the biosynthesis of C9- from C10-monoterpenoid indole alkaloids - Yang_2009_Angew.Chem.Int.Ed.Engl_48_5211 |
| Author(s) : Yang L , Hill M , Wang M , Panjikar S , Stockigt J |
| Ref : Angew Chem Int Ed Engl , 48 :5211 , 2009 |
| Abstract : Yang_2009_Angew.Chem.Int.Ed.Engl_48_5211 |
| ESTHER : Yang_2009_Angew.Chem.Int.Ed.Engl_48_5211 |
| PubMedSearch : Yang_2009_Angew.Chem.Int.Ed.Engl_48_5211 |
| PubMedID: 19496101 |
| Gene_locus related to this paper: rause-pnae |