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Chemistry

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Also known as:
Molecular Formula
C20H21CaN7O7
Molecular Weight
511.5  g/mol
InChI Key
KVUAALJSMIVURS-QNTKWALQSA-L

Levoleucovorin Calcium
1 2D Structure

Levoleucovorin Calcium

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
calcium;(2S)-2-[[4-[[(6S)-2-amino-5-formyl-4-oxo-1,6,7,8-tetrahydropteridin-6-yl]methylamino]benzoyl]amino]pentanedioate
2.1.2 InChI
InChI=1S/C20H23N7O7.Ca/c21-20-25-16-15(18(32)26-20)27(9-28)12(8-23-16)7-22-11-3-1-10(2-4-11)17(31)24-13(19(33)34)5-6-14(29)30;/h1-4,9,12-13,22H,5-8H2,(H,24,31)(H,29,30)(H,33,34)(H4,21,23,25,26,32);/q;+2/p-2/t12-,13-;/m0./s1
2.1.3 InChI Key
KVUAALJSMIVURS-QNTKWALQSA-L
2.1.4 Canonical SMILES
C1C(N(C2=C(N1)NC(=NC2=O)N)C=O)CNC3=CC=C(C=C3)C(=O)NC(CCC(=O)[O-])C(=O)[O-].[Ca+2]
2.1.5 Isomeric SMILES
C1[C@@H](N(C2=C(N1)NC(=NC2=O)N)C=O)CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-].[Ca+2]
2.2 Create Date
2006-10-25
3 Chemical and Physical Properties
Molecular Weight 511.5 g/mol
Molecular Formula C20H21CaN7O7
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count9
Rotatable Bond Count7
Exact Mass511.1128369 g/mol
Monoisotopic Mass511.1128369 g/mol
Topological Polar Surface Area221 A^2
Heavy Atom Count35
Formal Charge0
Complexity900
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2

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[{"dataSource":"API Export","activeIngredients":"","year":"2022","qtr":"Q2","strtotime":1652380200,"product":"N-NITROSO CALCIUM LEVOFOLINATE-2 - PF-07","address":"HOTEL DREAMZ PARK OFFICE COMPLEX\\r\\nUNIT G, 571\/2, ANNA SALAI,\\r\\nTEYNAMPET, CHENNAI, TAMIL NADU.","city":"CHENNAI,","supplier":"PFIZER INC","supplierCountry":"INDIA","foreign_port":"CHICAGO O\\'HARE INT\\'L","customer":"PFIZER INC","customerCountry":"UNITED STATES","quantity":"0.10","actualQuantity":"100","unit":"GMS","unitRateFc":"1.1","totalValueFC":"103.5","currency":"USD","unitRateINR":80,"date":"13-May-2022","totalValueINR":"8000","totalValueInUsd":"103.5","indian_port":"HYDERABAD AIR","hs_no":"29349990","bill_no":"1374645","productDescription":"API","marketType":"REGULATED MARKET","country":"UNITED STATES","selfForZScoreResived":"Pharma Grade","supplierPort":"HYDERABAD AIR","supplierAddress":"HOTEL DREAMZ PARK OFFICE COMPLEX\\r\\nUNIT G, 571\/2, ANNA SALAI,\\r\\nTEYNAMPET, CHENNAI, TAMIL NADU., CHENNAI,","customerAddress":""},{"dataSource":"API Export","activeIngredients":"","year":"2024","qtr":"Q3","strtotime":1719772200,"product":"PHARMACEUTICAL RAW MATERIAL ( BULK DRUGS):SODIUM LEVOFOLINATE","address":"KAMALA BHUVAN NO.2, 1ST FLR. NO.37","city":"BOMBAY ,MAHARASHTRA","supplier":"TRICON ENTERPRISES PRIVATE LIMITED","supplierCountry":"INDIA","foreign_port":"SEOUL - INCHEON INT\\'","customer":"ABO. CO.LTD.","customerCountry":"REPUBLIC OF KOREA","quantity":"5.50","actualQuantity":"5.5","unit":"KGS","unitRateFc":"3000","totalValueFC":"16014","currency":"USD","unitRateINR":243386.18181818182,"date":"01-Jul-2024","totalValueINR":"1338624","totalValueInUsd":"16014","indian_port":"Bombay Air","hs_no":"29362990","bill_no":"2079485","productDescription":"API","marketType":"REGULATED MARKET","country":"REPUBLIC OF KOREA","selfForZScoreResived":"Pharma Grade","supplierPort":"Bombay Air","supplierAddress":"KAMALA BHUVAN NO.2, 1ST FLR. NO.37, BOMBAY ,MAHARASHTRA","customerAddress":""},{"dataSource":"API Import","activeIngredients":"","year":"2021","qtr":"Q3","strtotime":1630434600,"product":"CALCIUM LEVOFOLINATE CONFORMING TO EP","address":"882\/1-871, NEAR KANKAVATI ,VILLAGE-","city":"AHMEDABAD, GUJARAT","supplier":"CERBIOS-PHARMA SA","supplierCountry":"SWITZERLAND","foreign_port":"N\/A","customer":"AMNEAL PHARMACEUTICALS","customerCountry":"INDIA","quantity":"5.00","actualQuantity":"5","unit":"KGS","unitRateFc":"16170.4","totalValueFC":"82658.6","currency":"USD","unitRateINR":"1216014","date":"01-Sep-2021","totalValueINR":"6080070","totalValueInUsd":"82658.6","indian_port":"Ahmedabad-ZIPL-SEZ","hs_no":"29362990","bill_no":"1003426","productDescription":"API","marketType":"REGULATED MARKET","country":"SWITZERLAND","selfForZScoreResived":"Pharma Grade","supplierPort":"N\/A","supplierAddress":"VIA FIGINO 6 6917 BARBENGO\/LUGANO SWITZERLAND SWITZERLAND","customerAddress":"882\/1-871, NEAR KANKAVATI ,VILLAGE-"}]
01-Sep-2021
01-Jul-2024
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DRUG PRODUCT COMPOSITIONS

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DOSAGE - SOLUTION;INTRAVENOUS - EQ 175MG BASE...DOSAGE - SOLUTION;INTRAVENOUS - EQ 175MG BASE/17.5ML (EQ 10MG BASE/ML) **Federal Register determination that product was not discontinued or withdrawn for safety or effectiveness reasons**

USFDA APPLICATION NUMBER - 20140

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DOSAGE - SOLUTION;INTRAVENOUS - EQ 250MG BASE...DOSAGE - SOLUTION;INTRAVENOUS - EQ 250MG BASE/25ML (EQ 10MG BASE/ML) **Federal Register determination that product was not discontinued or withdrawn for safety or effectiveness reasons**

USFDA APPLICATION NUMBER - 20140

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DOSAGE - POWDER;INTRAVENOUS - EQ 50MG BASE/VI...DOSAGE - POWDER;INTRAVENOUS - EQ 50MG BASE/VIAL

USFDA APPLICATION NUMBER - 20140

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DOSAGE - POWDER;INTRAVENOUS - EQ 175MG BASE/V...DOSAGE - POWDER;INTRAVENOUS - EQ 175MG BASE/VIAL

USFDA APPLICATION NUMBER - 208723

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