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Saridegib

Saridegib

CAS号：1037210-93-7

英文名：N-[(3R,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9S,12aS,12bS)-3',6',11,12b-tetramethylspiro[1,2,3,4,4a,5,6,6a,6b,7,8,10,12,12a-tetradecahydronaphtho[2,1-a]azulene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide

分子式

C29H48N2O3S

熔点

密度

分子量

504.768

沸点

溶解度

信号词

危险品标志

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化合物简介

Saridegib also known as IPI-926 is an experimental drug candidate undergoing clinical trials for the treatment of various types of cancer, including hard to treat hematologic malignancies such as myelofibrosis and ligand-dependant tumors such as chondrosarcoma. IPI-926 exhibits its pharmacological effect by inhibition of the G protein-coupled receptor smoothened, a component of the hedgehog signaling pathway. Chemically, it is a semi-synthetic derivative of the alkaloid cyclopamine. The process begins with cyclopamine extracted from harvested Veratrum californicum which is taken through a series of alterations resulting in an analogue of the natural product cyclopamine, making IPI-926 the only compound in development/testing that is not fully synthetic.

基本信息

中文名称

Saridegib

英文名称

N-[(3R,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9S,12aS,12bS)-3',6',11,12b-tetramethylspiro[1,2,3,4,4a,5,6,6a,6b,7,8,10,12,12a-tetradecahydronaphtho[2,1-a]azulene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]methanesulfonamide

中文别名

英文别名

UNII-JT96FPU35X、IP9 FREE BASE、IPI 926、SARIDEGIB、FIN-5

CAS号

1037210-93-7

分子式

C29H48N2O3S

分子量

504.768

精确质量

504.339

PSA

75.81

LOGP

6.8293

编号系统

UNII

JT96FPU35X

合成路线

benzyl (2S,3R,3aS,3'R,4a'R,6S,6a'R,6b'S,7aR,12a'S,12b'S)-3,6,11',12b'-tetramethyl-3'-(methylsulfonamido)-2',3,3a,3',4',4a',5,5',6,6',6a',6b',7,7a,7',8',10',12',12a',12b'-icosahydro-1'H,4H-spiro[furo[3,2-b]pyridine-2,9'-naphtho[2,1-a]azulene]-4-carboxylate

benzyl (2S,3R,3aS,3'R,4a'R,6S,6a'R,6b'S,7aR,12a'S,12b'S)-3,6,11',12b'-tetramethyl-3'-(methylsulfonamido)-2',3,3a,3',4',4a',5,5',6,6',6a',6b',7,7a,7',8',10',12',12a',12b'-icosahydro-1'H,4H-spiro[furo[3,2-b]pyridine-2,9'-naphtho[2,1-a]azulene]-4-carboxylate

Saridegib

上游原料

共找到5个上游原料 >

benzyl (2S,3R,3aS,3'R,4a'R,6S,6a'R,6b'S,7aR,12a'S,12b'S)-3'-azido-3,6,11',12b'-tetramethyl-2',3,3a,3',4',4a',5,5',6,6',6a',6b',7,7a,7',8',10',12',12a',12b'-icosahydro-1'H,4H-spiro[furo[3,2-b]pyridine-2,9'-naphtho[2,1-a]azulene]-4-carboxylate

benzyl (2S,3R,3aS,3'R,4a'R,6S,6a'R,6b'S,7aR,12a'S,12b'S)-3'-azido-3,6,11',12b'-tetramethyl-2',3,3a,3',4',4a',5,5',6,6',6a',6b',7,7a,7',8',10',12',12a',12b'-icosahydro-1'H,4H-spiro[furo[3,2-b]pyridine-2,9'-naphtho[2,1-a]azulene]-4-carboxylate

benzyl (2S,3R,3aS,3'R,4a'R,6S,6a'R,6b'S,7aR,12a'S,12b'S)-3'-amino-3,6,11',12b'-tetramethyl-2',3,3a,3',4',4a',5,5',6,6',6a',6b',7,7a,7',8',10',12',12a',12b'-icosahydro-1'H,4H-spiro[furo[3,2-b]pyridine-2,9'-naphtho[2,1-a]azulene]-4-carboxylate

benzyl (2S,3R,3aS,3'R,4a'R,6S,6a'R,6b'S,7aR,12a'S,12b'S)-3'-amino-3,6,11',12b'-tetramethyl-2',3,3a,3',4',4a',5,5',6,6',6a',6b',7,7a,7',8',10',12',12a',12b'-icosahydro-1'H,4H-spiro[furo[3,2-b]pyridine-2,9'-naphtho[2,1-a]azulene]-4-carboxylate

benzyl (2S,3R,3aS,4a'R,6S,6a'R,6b'S,7aR,12a'S,12b'S)-3,6,11',12b'-tetramethyl-3'-oxo-2',3,3a,3',4',4a',5,5',6,6',6a',6b',7,7a,7',8',10',12',12a',12b'-icosahydro-1'H,4H-spiro[furo[3,2-b]pyridine-2,9'-naphtho[2,1-a]azulene]-4-carboxylate

benzyl (2S,3R,3aS,4a'R,6S,6a'R,6b'S,7aR,12a'S,12b'S)-3,6,11',12b'-tetramethyl-3'-oxo-2',3,3a,3',4',4a',5,5',6,6',6a',6b',7,7a,7',8',10',12',12a',12b'-icosahydro-1'H,4H-spiro[furo[3,2-b]pyridine-2,9'-naphtho[2,1-a]azulene]-4-carboxylate

benzyl (2S,3R,3aS,3'R,4a'R,6S,6a'R,6b'S,7aR,12a'S,12b'S)-3,6,11',12b'-tetramethyl-3'-(methylsulfonamido)-2',3,3a,3',4',4a',5,5',6,6',6a',6b',7,7a,7',8',10',12',12a',12b'-icosahydro-1'H,4H-spiro[furo[3,2-b]pyridine-2,9'-naphtho[2,1-a]azulene]-4-carboxylate

benzyl (2S,3R,3aS,3'R,4a'R,6S,6a'R,6b'S,7aR,12a'S,12b'S)-3,6,11',12b'-tetramethyl-3'-(methylsulfonamido)-2',3,3a,3',4',4a',5,5',6,6',6a',6b',7,7a,7',8',10',12',12a',12b'-icosahydro-1'H,4H-spiro[furo[3,2-b]pyridine-2,9'-naphtho[2,1-a]azulene]-4-carboxylate

benzyl (2S,3R,3aS,3'S,4a'R,6S,6a'R,6b'S,7aR,12a'S,12b'S)-3'-hydroxy-3,6,11',12b'-tetramethyl-2',3,3a,3',4',4a',5,5',6,6',6a',6b',7,7a,7',8',10',12',12a',12b'-icosahydro-1'H,4H-spiro[furo[3,2-b]pyridine-2,9'-naphtho[2,1-a]azulene]-4-carboxylate

benzyl (2S,3R,3aS,3'S,4a'R,6S,6a'R,6b'S,7aR,12a'S,12b'S)-3'-hydroxy-3,6,11',12b'-tetramethyl-2',3,3a,3',4',4a',5,5',6,6',6a',6b',7,7a,7',8',10',12',12a',12b'-icosahydro-1'H,4H-spiro[furo[3,2-b]pyridine-2,9'-naphtho[2,1-a]azulene]-4-carboxylate

上游原料

benzyl (2S,3R,3aS,3'R,4a'R,6S,6a'R,6b'S,7aR,12a'S,12b'S)-3'-azido-3,6,11',12b'-tetramethyl-2',3,3a,3',4',4a',5,5',6,6',6a',6b',7,7a,7',8',10',12',12a',12b'-icosahydro-1'H,4H-spiro[furo[3,2-b]pyridine-2,9'-naphtho[2,1-a]azulene]-4-carboxylate benzyl (2S,3R,3aS,3'R,4a'R,6S,6a'R,6b'S,7aR,12a'S,12b'S)-3'-amino-3,6,11',12b'-tetramethyl-2',3,3a,3',4',4a',5,5',6,6',6a',6b',7,7a,7',8',10',12',12a',12b'-icosahydro-1'H,4H-spiro[furo[3,2-b]pyridine-2,9'-naphtho[2,1-a]azulene]-4-carboxylate benzyl (2S,3R,3aS,4a'R,6S,6a'R,6b'S,7aR,12a'S,12b'S)-3,6,11',12b'-tetramethyl-3'-oxo-2',3,3a,3',4',4a',5,5',6,6',6a',6b',7,7a,7',8',10',12',12a',12b'-icosahydro-1'H,4H-spiro[furo[3,2-b]pyridine-2,9'-naphtho[2,1-a]azulene]-4-carboxylate benzyl (2S,3R,3aS,3'R,4a'R,6S,6a'R,6b'S,7aR,12a'S,12b'S)-3,6,11',12b'-tetramethyl-3'-(methylsulfonamido)-2',3,3a,3',4',4a',5,5',6,6',6a',6b',7,7a,7',8',10',12',12a',12b'-icosahydro-1'H,4H-spiro[furo[3,2-b]pyridine-2,9'-naphtho[2,1-a]azulene]-4-carboxylate benzyl (2S,3R,3aS,3'S,4a'R,6S,6a'R,6b'S,7aR,12a'S,12b'S)-3'-hydroxy-3,6,11',12b'-tetramethyl-2',3,3a,3',4',4a',5,5',6,6',6a',6b',7,7a,7',8',10',12',12a',12b'-icosahydro-1'H,4H-spiro[furo[3,2-b]pyridine-2,9'-naphtho[2,1-a]azulene]-4-carboxylate