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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H19Cl2N3O4.ClH.H2O
Molecular Weight 526.797
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Nanvuranlat hydrochloride monohydrate

SMILES

O.Cl.N[C@@H](CC1=CC(Cl)=C(OCC2=C3OC(=NC3=CC(N)=C2)C4=CC=CC=C4)C(Cl)=C1)C(O)=O

InChI

InChIKey=HGHCRNUONAQSIZ-NTEVMMBTSA-N
InChI=1S/C23H19Cl2N3O4.ClH.H2O/c24-16-6-12(8-18(27)23(29)30)7-17(25)21(16)31-11-14-9-15(26)10-19-20(14)32-22(28-19)13-4-2-1-3-5-13;;/h1-7,9-10,18H,8,11,26-27H2,(H,29,30);1H;1H2/t18-;;/m0../s1

HIDE SMILES / InChI

Molecular Formula C23H19Cl2N3O4
Molecular Weight 472.321
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula H2O
Molecular Weight 18.0153
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Target ID: Q01650
Gene ID: 8140.0
Gene Symbol: SLC7A5
Target Organism: Homo sapiens (Human)
AUC

AUC

ValueDoseCo-administeredAnalytePopulation
463.1 ng × h/mL
12 mg/m² single, intravenous
dose: 12 mg/m²
route of administration: Intravenous
experiment type: SINGLE
co-administered:
JPH-203 plasma
Homo sapiens
population: UNHEALTHY
age: ADULT
sex: FEMALE / MALE
food status: UNKNOWN
887.8 ng × h/mL
25 mg/m² single, intravenous
dose: 25 mg/m²
route of administration: Intravenous
experiment type: SINGLE
co-administered:
JPH-203 plasma
Homo sapiens
population: UNHEALTHY
age: ADULT
sex: FEMALE / MALE
food status: UNKNOWN
1460.5 ng × h/mL
40 mg/m² single, intravenous
dose: 40 mg/m²
route of administration: Intravenous
experiment type: SINGLE
co-administered:
JPH-203 plasma
Homo sapiens
population: UNHEALTHY
age: ADULT
sex: FEMALE / MALE
food status: UNKNOWN
2094.3 ng × h/mL
60 mg/m² single, intravenous
dose: 60 mg/m²
route of administration: Intravenous
experiment type: SINGLE
co-administered:
JPH-203 plasma
Homo sapiens
population: UNHEALTHY
age: ADULT
sex: FEMALE / MALE
food status: UNKNOWN
3022.5 ng × h/mL
85 mg/m² single, intravenous
dose: 85 mg/m²
route of administration: Intravenous
experiment type: SINGLE
co-administered:
JPH-203 plasma
Homo sapiens
population: UNHEALTHY
age: ADULT
sex: UNKNOWN
food status: UNKNOWN
Substance Class Chemical
Created
by admin
on Wed Apr 02 19:47:41 GMT 2025
Edited
by admin
on Wed Apr 02 19:47:41 GMT 2025
Record UNII
LP8BGN8JPC
Record Status Validated (UNII)
Record Version
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Name Type Language
L-Tyrosine, O-[(5-amino-2-phenyl-7-benzoxazolyl)methyl]-3,5-dichloro-, hydrochloride, hydrate (1:1:1)
Preferred Name English
Nanvuranlat hydrochloride monohydrate
Common Name English
Code System Code Type Description
CAS
2417321-16-3
Created by admin on Wed Apr 02 19:47:41 GMT 2025 , Edited by admin on Wed Apr 02 19:47:41 GMT 2025
PRIMARY
PUBCHEM
171904561
Created by admin on Wed Apr 02 19:47:41 GMT 2025 , Edited by admin on Wed Apr 02 19:47:41 GMT 2025
PRIMARY
FDA UNII
LP8BGN8JPC
Created by admin on Wed Apr 02 19:47:41 GMT 2025 , Edited by admin on Wed Apr 02 19:47:41 GMT 2025
PRIMARY
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