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Details

Stereochemistry ABSOLUTE
Molecular Formula 2C33H34FN2O5.Ca.3H2O
Molecular Weight 1209.388
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ATORVASTATIN CALCIUM TRIHYDRATE

SMILES

O.O.O.[Ca++].CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC([O-])=O)C3=CC=C(F)C=C3)C4=CC=CC=C4.CC(C)C5=C(C(=O)NC6=CC=CC=C6)C(=C(N5CC[C@@H](O)C[C@@H](O)CC([O-])=O)C7=CC=C(F)C=C7)C8=CC=CC=C8

InChI

InChIKey=SHZPNDRIDUBNMH-NIJVSVLQSA-L
InChI=1S/2C33H35FN2O5.Ca.3H2O/c2*1-21(2)31-30(33(41)35-25-11-7-4-8-12-25)29(22-9-5-3-6-10-22)32(23-13-15-24(34)16-14-23)36(31)18-17-26(37)19-27(38)20-28(39)40;;;;/h2*3-16,21,26-27,37-38H,17-20H2,1-2H3,(H,35,41)(H,39,40);;3*1H2/q;;+2;;;/p-2/t2*26-,27-;;;;/m11..../s1

HIDE SMILES / InChI

Approval Year

Unknown
86413
Name Type Language
ATORVASTATIN CALCIUM TRIHYDRATE
EP   WHO-DD  
Common Name English
ATORVASTATIN CALCIUM [USP MONOGRAPH]
Common Name English
SORTIS
Brand Name English
ATORVASTATIN CALCIUM HYDRATE
JAN  
Common Name English
CI-981
Code English
TOTALIP
Brand Name English
ATORVASTATIN CALCIUM [VANDF]
Common Name English
LIPITOR
Brand Name English
ATORVASTATIN CALCIUM
ORANGE BOOK   USAN   USP-RS   VANDF  
USAN  
Common Name English
ATORVASTATIN CALCIUM TRIHYDRATE [EP MONOGRAPH]
Common Name English
ATORVASTATIN CALCIUM SALT TRIHYDRATE [MI]
Common Name English
1H-PYRROLE-1-HEPTANOIC ACID, 2-(4 FLUOROPHENYL)-.BETA.,.DELTA.-DIHYDROXY-5-(1-METHYLETHYL)-3-PHENYL-4-((PHENYLAMINO)CARBONYL)-, CALCIUM SALT, HYDRATE(2:1:3), (.BETA.R,.DELTA.R)-
Systematic Name English
TORVAST
Brand Name English
Atorvastatin calcium trihydrate [WHO-DD]
Common Name English
ATORVASTATIN CALCIUM HYDRATE [JAN]
Common Name English
ATORVASTATIN CALCIUM [USP-RS]
Common Name English
ATORVASTATIN CALCIUM TRIHYDRATE [EP IMPURITY]
Common Name English
1H-PYRROLE-1-HEPTANOIC ACID, 2-(4-FLUOROPHENYL)-B,D-DIHYDROXY-5-(1-METHYLETHYL)-3-PHENYL-4-((PHENYLAMINO)CARBONYL)-, CALCIUM SALT (2:1), (R-(R*,R*))-, TRIHYDRATE
Systematic Name English
ATORVASTATIN CALCIUM COMPONENT OF CADUET
Brand Name English
ATORVALIQ
Brand Name English
ATORVASTATIN (AS CALCIUM)
Common Name English
ATORVASTATIN CALCIUM [ORANGE BOOK]
Common Name English
Ocustatin component atorvastatin calcium trihydrate
Common Name English
ATORVASTATIN CALCIUM [USAN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C1655
Created by admin on Fri Dec 15 15:31:22 UTC 2023 , Edited by admin on Fri Dec 15 15:31:22 UTC 2023
Code System Code Type Description
CAS
344423-98-9
Created by admin on Fri Dec 15 15:31:22 UTC 2023 , Edited by admin on Fri Dec 15 15:31:22 UTC 2023
PRIMARY
RXCUI
1297766
Created by admin on Fri Dec 15 15:31:22 UTC 2023 , Edited by admin on Fri Dec 15 15:31:22 UTC 2023
PRIMARY
EVMPD
SUB12958MIG
Created by admin on Fri Dec 15 15:31:22 UTC 2023 , Edited by admin on Fri Dec 15 15:31:22 UTC 2023
PRIMARY
ChEMBL
CHEMBL1487
Created by admin on Fri Dec 15 15:31:22 UTC 2023 , Edited by admin on Fri Dec 15 15:31:22 UTC 2023
PRIMARY
DAILYMED
48A5M73Z4Q
Created by admin on Fri Dec 15 15:31:22 UTC 2023 , Edited by admin on Fri Dec 15 15:31:22 UTC 2023
PRIMARY
SMS_ID
100000091257
Created by admin on Fri Dec 15 15:31:22 UTC 2023 , Edited by admin on Fri Dec 15 15:31:22 UTC 2023
PRIMARY
CHEBI
50686
Created by admin on Fri Dec 15 15:31:22 UTC 2023 , Edited by admin on Fri Dec 15 15:31:22 UTC 2023
PRIMARY
EVMPD
SUB26255
Created by admin on Fri Dec 15 15:31:22 UTC 2023 , Edited by admin on Fri Dec 15 15:31:22 UTC 2023
PRIMARY
EPA CompTox
DTXSID50110042
Created by admin on Fri Dec 15 15:31:22 UTC 2023 , Edited by admin on Fri Dec 15 15:31:22 UTC 2023
PRIMARY
DRUG BANK
DBSALT000011
Created by admin on Fri Dec 15 15:31:22 UTC 2023 , Edited by admin on Fri Dec 15 15:31:22 UTC 2023
PRIMARY
RS_ITEM_NUM
1044516
Created by admin on Fri Dec 15 15:31:22 UTC 2023 , Edited by admin on Fri Dec 15 15:31:22 UTC 2023
PRIMARY
RXCUI
83366
Created by admin on Fri Dec 15 15:31:22 UTC 2023 , Edited by admin on Fri Dec 15 15:31:22 UTC 2023
ALTERNATIVE
FDA UNII
48A5M73Z4Q
Created by admin on Fri Dec 15 15:31:22 UTC 2023 , Edited by admin on Fri Dec 15 15:31:22 UTC 2023
PRIMARY
EVMPD
SUB25768
Created by admin on Fri Dec 15 15:31:22 UTC 2023 , Edited by admin on Fri Dec 15 15:31:22 UTC 2023
PRIMARY
USAN
FF-77
Created by admin on Fri Dec 15 15:31:22 UTC 2023 , Edited by admin on Fri Dec 15 15:31:22 UTC 2023
PRIMARY
CHEBI
2911
Created by admin on Fri Dec 15 15:31:22 UTC 2023 , Edited by admin on Fri Dec 15 15:31:22 UTC 2023
PRIMARY
NCI_THESAURUS
C28837
Created by admin on Fri Dec 15 15:31:22 UTC 2023 , Edited by admin on Fri Dec 15 15:31:22 UTC 2023
PRIMARY
PUBCHEM
656846
Created by admin on Fri Dec 15 15:31:22 UTC 2023 , Edited by admin on Fri Dec 15 15:31:22 UTC 2023
PRIMARY
MERCK INDEX
m2125
Created by admin on Fri Dec 15 15:31:22 UTC 2023 , Edited by admin on Fri Dec 15 15:31:22 UTC 2023
PRIMARY
ACTIVE MOIETY
Structure of ATORVASTATIN
NIH
NCATS
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