Chem
J-GLOBAL ID:200907095044151600
Nikkaji number:J1.361.854B
Fradafiban
フラダフィバン
Download MOL file
Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C20 H21 N3 O4
Molecular formula furigana:
C20-H21-N3-O4
Molecular weight:
367.405
InChI:
InChI=1S/C20H21N3O4/c21-19(22)14-3-1-12(2-4-14)13-5-7-17(8-6-13)27-11-16-9-15(10-18(24)25)20(26)23-16/h1-8,15-16H,9-11H2,(H3,21,22)(H,23,26)(H,24,25)/t15-,16-/m0/s1
InChI key:
IKZACQMAVUIGPY-HOTGVXAUSA-N
SMILES:
NC(=N)c1ccc(cc1)c1ccc(OC[C@@H]2C[C@@H](CC(=O)O)C(=O)N2)cc1
Systematic name (3):
(3S,5S)-5-[[[4′-(アミノイミノメチル)[1,1′-ビフェニル]-4-イル]オキシ]メチル]-2-オキソ-3-ピロリジン酢酸
2-[(3S,5S)-5-[({4'-カルバムイミドイル-[1,1'-ビフェニル]-4-イル}オキシ)メチル]-2-オキソピロリジン-3-イル]酢酸
2-[(3S,5S)-5-[({4'-carbamimidoyl-[1,1'-biphenyl]-4-yl}oxy)methyl]-2-oxopyrrolidin-3-yl]acetic acid
Other name (3):
(3S,5S)-5-[[[4′-(Aminoiminomethyl)[1,1′-biphenyl]-4-yl]oxy]methyl]-2-oxo-3-pyrrolidineacetic acid
Fradafiban
フラダフィバン
CAS registry number:
148396-36-5
Thsaurus map:
Return to Previous Page