Chem
J-GLOBAL ID：201507092394123080   Nikkaji number：J3.339.850F

Lorlatinib

ロルラチニブ
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： C21H19FN6O2
Molecular formula furigana： C21-H19-F-N6-O2
Molecular weight： 406.421
InChI： InChI=1S/C21H19FN6O2/c1-11-15-7-13(22)4-5-14(15)21(29)27(2)10-16-19(17(8-23)28(3)26-16)12-6-18(30-11)20(24)25-9-12/h4-7,9,11H,10H2,1-3H3,(H2,24,25)
InChI key： IIXWYSCJSQVBQM-UHFFFAOYSA-N
SMILES： CC1Oc2cc(cnc2N)c2c(CN(C)C(=O)c3ccc(F)cc13)nn(C)c2C#N
Systematic name  (4)：
  • (3R)-21-アミノ-6-フルオロ-10-オキソ-3,11,15-トリメチル-2-オキサ-11,14,15,20-テトラアザテトラシクロ[16.3.1.04,9.013,17]ドコサン-1(21),4(9),5,7,13,16,18(22),19-オクタエン-16-カルボニトリル
  • (19R)-16-アミノ-2-フルオロ-6,9,10,15-テトラアザ-6,10,19-トリメチル-18-オキサ-5-オキソ-8,12-シクロ-13,17-メテノ-6,7,10,17,18,19-ヘキサヒドロ-5H-ベンゾシクロヘプタデセン-11-カルボニトリル
  • (16R)-19-アミノ-13-フルオロ-4,8,16-トリメチル-9-オキソ-17-オキサ-4,5,8,20-テトラアザテトラシクロ[16.3.1.02,6.010,15]ドコサ-1(21),2,5,10,12,14,18(22),19-オクタエン-3-カルボニトリル
  • (16R)-19-amino-13-fluoro-4,8,16-trimethyl-9-oxo-17-oxa-4,5,8,20-tetraazatetracyclo[16.3.1.02,6.010,15]docosa-1(21),2,5,10,12,14,18(22),19-octaene-3-carbonitrile
Other name (5)：
  • (3R)-21-Amino-6-fluoro-10-oxo-3,11,15-trimethyl-2-oxa-11,14,15,20-tetraazatetracyclo[16.3.1.04,9.013,17]docosan-1(21),4(9),5,7,13,16,18(22),19-octene-16-carbonitrile
  • PF-06463922
  • (19R)-16-Amino-2-fluoro-6,9,10,15-tetraaza-6,10,19-trimethyl-18-oxa-5-oxo-8,12-cyclo-13,17-metheno-6,7,10,17,18,19-hexahydro-5H-benzocycloheptadecene-11-carbonitrile
  • ロルラチニブ
  • Lorlatinib
CAS registry number： 1454846-35-5
Application (3)：
antitumor drug ,  enzyme inhibitor ,  molecular targeting drug
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