DIMETHYL (1S,9S)-5-CYANOSEMICORRIN-1,9-DICARBOXYLATE ,105251-49-8

DIMETHYL (1S,9S)-5-CYANOSEMICORRIN-1,9-DICARBOXYLATE

Basic Information
Product Name：	DIMETHYL (1S,9S)-5-CYANOSEMICORRIN-1,9-DICARBOXYLATE
CAS：	105251-49-8
English Synonyms：	SEMICORRIN CHIRAL LIGAND 1 ; 5-CYANOSEMICORRIN-1,9-DICARBOXYLIC ACID, (1S,9S)-FORM, DI-METHYL ESTER ; DIMETHYL (1S,9S)-5-CYANOSEMICORRIN-1,9-DICARBOXYLATE ; 5-CYANOSEMICORRIN-1,9-DICARBOXYLIC ACID, (1S,9S)-FORM, DI-ME ESTER
MDL Number.：	MFCD00144132
H bond acceptor：	7
H bond donor：	1
Smile：	COC(=O)[C@@H]1CC/C(=C(\C#N)/C2=N[C@@H](CC2)C(=O)OC)/N1
InChi：	InChI=1S/C14H17N3O4/c1-20-13(18)11-5-3-9(16-11)8(7-15)10-4-6-12(17-10)14(19)21-2/h11-12,16H,3-6H2,1-2H3/b9-8-/t11-,12-/m0/s1
InChiKey：	InChIKey=HEMMGWQVSFWCAQ-RTVKQWPZSA-N

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