Streptonigrin-derivative
General
Type : Pyridine || Quinoline
Chemical_Nomenclature : methyl (4Z)-5-amino-6-(7-amino-6-methoxy-5,8-dioxoquinolin-2-yl)-4-(5-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)-3-methyl-1H-pyridine-2-carboxylate
Canonical SMILES : CC1=C(NC(=C(C1=C2C=CC=C(C2=O)OC)N)C3=NC4=C(C=C3)C(=O)C(=C(C4=O)N)OC)C(=O)OC
InChI : InChI=1S\/C25H22N4O7\/c1-10-15(11-6-5-7-14(34-2)21(11)30)16(26)20(29-18(10)25(33)36-4)13-9-8-12-19(28-13)23(32)17(27)24(35-3)22(12)31\/h5-9,29H,26-27H2,1-4H3\/b15-11-
InChIKey : DWCOYSSFAKQYAB-PTNGSMBKSA-N
Other name(s) : Methyl 5-Amino-6-(7-Amino-6-Methoxy-5,8-Dioxo-5,8-Dihydroquinolin-2-Yl)-4-(2-Hydroxy-3-Methoxyphenyl)-3-Methylpyridine-2-Carboxylate, methyl ester of 10'-demethoxystreptonigrin, STM
MW : 490.47
Formula : C25H22N4O7
CAS_number :
PubChem :
UniChem :
Iuphar :
Target
Families : 6_AlphaBeta_hydrolase
References (1)
| Title : Crystal Structure of StnA for the Biosynthesis of Antitumor Drug Streptonigrin Reveals a Unique Substrate Binding Mode - Qian_2017_Sci.Rep_7_40254 |
| Author(s) : Qian T , Wo J , Zhang Y , Song Q , Feng G , Luo R , Lin S , Wu G , Chen HF |
| Ref : Sci Rep , 7 :40254 , 2017 |
| Abstract : Qian_2017_Sci.Rep_7_40254 |
| ESTHER : Qian_2017_Sci.Rep_7_40254 |
| PubMedSearch : Qian_2017_Sci.Rep_7_40254 |
| PubMedID: 28074848 |
| Gene_locus related to this paper: 9actn-l7pij2 |