ROSUVASTATIN

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H28FN3O6S
Molecular Weight	481.538
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of ROSUVASTATIN

Structure Search

SMILES

CC(C)C1=NC(=NC(C2=CC=C(F)C=C2)=C1\C=C\[C@@H](O)C[C@@H](O)CC(O)=O)N(C)S(C)(=O)=O

InChI

InChIKey=BPRHUIZQVSMCRT-VEUZHWNKSA-N

InChI=1S/C22H28FN3O6S/c1-13(2)20-18(10-9-16(27)11-17(28)12-19(29)30)21(14-5-7-15(23)8-6-14)25-22(24-20)26(3)33(4,31)32/h5-10,13,16-17,27-28H,11-12H2,1-4H3,(H,29,30)/b10-9+/t16-,17-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C22H28FN3O6S
Molecular Weight	481.538
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:44:27 UTC 2023` Edited by `admin` on `Fri Dec 15 15:44:27 UTC 2023`
Record UNII	413KH5ZJ73
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ROSUVASTATIN

Official Name

English

ROSUVASTATIN [HSDB]

Common Name

English

ZD4522

Code

English

ROSUVASTATIN [MI]

Common Name

English

6-HEPTENOIC ACID, 7-(4-(4-FLUOROPHENYL)-6-(1-METHYLETHYL)-2-(METHYL(METHYLSULFONYL)AMINO)-5-PYRIMIDINYL)-3,5-DIHYDROXY-, (3R,5S,6E)-

Common Name

English

(3R,5S,6E)-7-(4-(4-FLUOROPHENYL)-6-ISOPROPYL-2-(METHYL(METHYLSULFONYL)AMINO)PYRIMIDIN-5-YL)-3,5-DIHYDROXYHEPT-6-ENOIC ACID

Systematic Name

English

ROSUVASTATIN [VANDF]

Common Name

English

Rosuvastatin [WHO-DD]

Common Name

English

CRESTON

Brand Name

English

rosuvastatin [INN]

Common Name

English

X-PLENDED

Common Name

English

ZD-4522

Code

English

Classification Tree Code System Code

WHO-ATC

C10BX09

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

WHO-ATC

C10BX14

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

WHO-VATC

QC10BX05

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

WHO-ATC

C10BX07

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

WHO-ATC

C10AA07

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

NDF-RT

N0000000121

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

FDA ORPHAN DRUG

420513

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

WHO-ATC

A10BH52

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

WHO-ATC

C10BA06

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

WHO-VATC

QC10AA07

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

WHO-ATC

C10BX10

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

NCI_THESAURUS

C1655

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

WHO-ATC

C10BX13

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

LIVERTOX

NBK548620

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

WHO-ATC

C10BX05

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

NDF-RT

N0000175589

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

WHO-VATC

QC10BA06

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

Code System Code Type Description

CHEBI

38545

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

PRIMARY

NCI_THESAURUS

C66523

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

PRIMARY

SMS_ID

100000088232

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

PRIMARY

EPA CompTox

DTXSID8048492

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

PRIMARY

WIKIPEDIA

ROSUVASTATIN

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

PRIMARY

PUBCHEM

446157

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

PRIMARY

MESH

C422923

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

PRIMARY

DRUG CENTRAL

2406

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

PRIMARY

LACTMED

Rosuvastatin

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

PRIMARY

FDA UNII

413KH5ZJ73

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

PRIMARY

DAILYMED

413KH5ZJ73

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

PRIMARY

RXCUI

301542

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

PRIMARY

RxNorm

CAS

287714-41-4

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

PRIMARY

ChEMBL

CHEMBL1496

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

PRIMARY

EVMPD

SUB20634

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

PRIMARY

DRUG BANK

DB01098

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

PRIMARY

MERCK INDEX

m9672

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

PRIMARY

Merck Index

IUPHAR

2954

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

PRIMARY

INN

8021

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

PRIMARY

HSDB

7317

Created by admin on Fri Dec 15 15:44:27 UTC 2023 , Edited by admin on Fri Dec 15 15:44:27 UTC 2023

PRIMARY

Related Record Type Details


					70VE4E19Z7

ROSUVASTATIN ZINC

SALT/SOLVATE -> PARENT

Amount:


					413KH5ZJ73

EXCRETED UNCHANGED

Qualification:

FECAL

Amount:


					EB4FXISBG6

3-HYDROXY-3-METHYLGLUTARYL-COENZYME A REDUCTASE

TARGET -> INHIBITOR

Amount:


					83MVU38M7Q

ROSUVASTATIN CALCIUM

SALT/SOLVATE -> PARENT

Amount:


					AIN96D6SGL

OATP1B1

TRANSPORTER -> SUBSTRATE

Comments:

Km

Amount:


					76UB6O122H

ATP-BINDING CASSETTE SUB-FAMILY G MEMBER 2

TRANSPORTER -> SUBSTRATE


					76UB6O122H

ATP-BINDING CASSETTE SUB-FAMILY G MEMBER 2

TRANSPORTER -> INHIBITOR


					0ZGFTBKJ9A

SODIUM/BILE ACID COTRANSPORTER

TRANSPORTER -> SUBSTRATE


					L9DP834D1P

CYTOCHROME P450 2C9

METABOLIC ENZYME -> SUBSTRATE

Interaction Type:

MAJOR

Amount:


					6D53G0FD0Z

PLASMA PROTEIN FRACTION (HUMAN)

BINDER->LIGAND

Amount:

Related Record Type Details


					ED3SYK2A2I

N-DESMETHYL ROSUVASTATIN

METABOLITE LESS ACTIVE -> PARENT

Comments:

N-desmethyl rosuvastatin has approximately one-sixth to one-half the HMG-CoA reductase inhibitory activity of the parent compound.

Amount:


					ED3SYK2A2I

N-DESMETHYL ROSUVASTATIN

METABOLITE LESS ACTIVE -> PARENT

Amount:


					FL37W41F3T

ROSUVASTATIN LACTONE

METABOLITE INACTIVE -> PARENT

Amount:

Related Record Type Details


					413KH5ZJ73

ACTIVE MOIETY

Amount:

Name	Property Type	Amount	Referenced Substance	Defining	Parameters	References
Biological Half-life	PHARMACOKINETIC

ORAL BIOAVAILABILITY	PHARMACOKINETIC

Volume of Distribution	PHARMACOKINETIC

MAXIMUM TOLERATED DOSE	TOXICITY

Tmax	PHARMACOKINETIC