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Details

Stereochemistry ABSOLUTE
Molecular Formula C28H31N3O8S
Molecular Weight 569.626
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FIRSOCOSTAT

SMILES

COC1=C(C=CC=C1)[C@H](CN2C3=C(C(C)=C(S3)C4=NC=CO4)C(=O)N(C2=O)C(C)(C)C(O)=O)OC5CCOCC5

InChI

InChIKey=ZZWWXIBKLBMSCS-FQEVSTJZSA-N
InChI=1S/C28H31N3O8S/c1-16-21-24(32)31(28(2,3)26(33)34)27(35)30(25(21)40-22(16)23-29-11-14-38-23)15-20(39-17-9-12-37-13-10-17)18-7-5-6-8-19(18)36-4/h5-8,11,14,17,20H,9-10,12-13,15H2,1-4H3,(H,33,34)/t20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C28H31N3O8S
Molecular Weight 569.626
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Cmax

ValueDoseCo-administeredAnalytePopulation
16.5 ng/mL
20 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
15.7 ng/mL
20 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
50.9 ng/mL
20 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
25.4 ng/mL
20 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
197.7 ng/mL
20 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
20.1 ng/mL
20 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
73.8 ng/mL
5 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
3 ng/mL
5 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens

AUC

ValueDoseCo-administeredAnalytePopulation
53.7 ng × h/mL
20 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
80.3 ng × h/mL
20 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
165.2 ng × h/mL
20 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
70.5 ng × h/mL
20 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
686.6 ng × h/mL
20 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
65.8 ng × h/mL
20 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
313.6 ng × h/mL
5 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
10.6 ng × h/mL
5 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens

T1/2

ValueDoseCo-administeredAnalytePopulation
6.7 h
20 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
14.2 h
20 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
5.23 h
20 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
3.32 h
20 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
12.82 h
20 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
3.28 h
20 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
8.51 h
5 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
2.49 h
5 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens

Funbound

ValueDoseCo-administeredAnalytePopulation
4.34%
20 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
3.44%
20 mg single, oral
FIRSOCOSTAT plasma
Homo sapiens
Substance Class Chemical
Record UNII
XE10NJQ95M
Record Status Validated (UNII)
Record Version