Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C28H26Cl2N4O5 |
Molecular Weight | 569.436 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
COC(=O)[C@H](CC1=CC=C(C=C1)N2C(=O)N(C)C3=C(C=C(C=C3)N(C)C)C2=O)NC(=O)C4=C(Cl)C=CC=C4Cl
InChI
InChIKey=MMHHPKCJJIFLBQ-QFIPXVFZSA-N
InChI=1S/C28H26Cl2N4O5/c1-32(2)18-12-13-23-19(15-18)26(36)34(28(38)33(23)3)17-10-8-16(9-11-17)14-22(27(37)39-4)31-25(35)24-20(29)6-5-7-21(24)30/h5-13,15,22H,14H2,1-4H3,(H,31,35)/t22-/m0/s1
Molecular Formula | C28H26Cl2N4O5 |
Molecular Weight | 569.436 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Carotegrast is phenylalanine derivative patented by pharmaceutical company Ajinomoto Co. for the treatment or prevention of inflammatory disease states related to the α4 integrin-dependent adhesion process. In preclinical studies, Carotegrast shows pharmacological activity in rheumatoid arthritis and inflammatory bowel disease.
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 05:42:24 GMT 2023
by
admin
on
Sat Dec 16 05:42:24 GMT 2023
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Record UNII |
OYK17DYO9M
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Record Status |
Validated (UNII)
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Record Version |
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OYK17DYO9M
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300000047273
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DTXSID60193189
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Related Record | Type | Details | ||
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METABOLITE ACTIVE -> PRODRUG |
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Related Record | Type | Details | ||
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ACTIVE MOIETY |