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Chemistry

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Also known as: 19764-30-8, Ac-d-leu-oh, D-leucine, n-acetyl-, N-acetyl-r-leucine, (2r)-2-acetamido-4-methylpentanoic acid, Acetylleucine, d-

Molecular Formula

C₈H₁₅NO₃

Molecular Weight

173.21 g/mol

InChI Key

WXNXCEHXYPACJF-SSDOTTSWSA-N

FDA UNII

91WU82GA22

N-Acetyl-D-leucine is a metabolite found in or produced by Saccharomyces cerevisiae.

1 2D Structure

N-Acetyl-D-Leucine

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(2R)-2-acetamido-4-methylpentanoic acid

2.1.2 InChI

InChI=1S/C8H15NO3/c1-5(2)4-7(8(11)12)9-6(3)10/h5,7H,4H2,1-3H3,(H,9,10)(H,11,12)/t7-/m1/s1

2.1.3 InChI Key

WXNXCEHXYPACJF-SSDOTTSWSA-N

2.1.4 Canonical SMILES

CC(C)CC(C(=O)O)NC(=O)C

2.1.5 Isomeric SMILES

CC(C)C[C@H](C(=O)O)NC(=O)C

2.2 Other Identifiers

2.2.1 UNII

91WU82GA22

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 19764-30-8

2. Ac-d-leu-oh

3. D-leucine, N-acetyl-

4. N-acetyl-r-leucine

5. (2r)-2-acetamido-4-methylpentanoic Acid

6. Acetylleucine, D-

7. Acetylleucine, (r)-

8. (r)-2-acetamido-4-methylpentanoic Acid

9. Leucine, N-acetyl-, D-

10. 91wu82ga22

11. Acetyl-d-leucine

12. Mfcd00066069

13. 2,n-acetyl-d-leucine

14. D-acetylleucine

15. Unii-91wu82ga22

16. (r)-acetylleucine

17. N-acetyl-d-leu

18. Ncgc00094935-01

19. N-acetyl-(d)-leucine

20. Schembl714003

21. Chembl174357

22. Chebi:94479

23. Dtxsid50361310

24. Chebi:146296

25. Act07449

26. Hy-y1080

27. Zinc3865059

28. S4514

29. Akos016842336

30. Akos025117328

31. Ccg-266380

32. Cs-w020713

33. Ds-1211

34. Fd21901

35. Ncgc00094935-02

36. Ac-22376

37. A0713

38. Am20090137

39. A-1455

40. A20910

41. 764a308

42. Q-100200

43. Brd-k05831461-001-01-8

2.4 Create Date

2005-07-10

3 Chemical and Physical Properties

Molecular Formula	C₈H₁₅NO₃
Molecular Weight	173.21 g/mol
XLogP3	0.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	173.10519334 g/mol
Monoisotopic Mass	173.10519334 g/mol
Topological Polar Surface Area	66.4 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	177
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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API Reference Price

[{"dataSource":"API Import","activeIngredients":"N-ACETYL-D-LEUCINE","year":"2021","qtr":"Q2","strtotime":1622226600,"product":"N-ACETYL-D-LEUCINE CAS:19764-30-8 (AS PER INVOICE)","address":"PLOT NO. 1143\/B,AA44\/A&1144\/B,PADRA JAMBUSAR RD, AT VILLAGE DABHASA","city":"TAL. PADRA, DIST. BARODA,GUJARAT","supplier":"HIGHPHARM MEDCHEM CO. ","supplierCountry":"CHINA","foreign_port":"","customer":"APOTHECON PHARMACEUTICALS","customerCountry":"INDIA","quantity":"1.00","actualQuantity":"1","unit":"KGS","unitRateFc":"650","totalValueFC":"657.5","currency":"USD","unitRateINR":"48165","date":"29-May-2021","totalValueINR":"48165","totalValueInUsd":"657.5","indian_port":"BOMBAY AIR","hs_no":"29241900","bill_no":"4130857","productDescription":"API","marketType":"REGULATED MARKET","country":"CHINA","selfForZScoreResived":"Pharma Grade","supplierPort":"","supplierAddress":"","customerAddress":"PLOT NO. 1143\/B,AA44\/A&1144\/B,PADRA JAMBUSAR RD, AT VILLAGE DABHASA"},{"dataSource":"API Import","activeIngredients":"","year":"2021","qtr":"Q4","strtotime":1639420200,"product":"N-ACETYL-D-LEUCINE","address":"7-2-A2, HETERO CORPORATE, INDUSTRIAL ESTATE, SANATHNAGAR, Con","city":"HYDERABAD","supplier":"ANGENE INTERNATIONAL LTD,","supplierCountry":"CHINA","foreign_port":"N\/A","customer":"HETERO DRUGS","customerCountry":"INDIA","quantity":"0.50","actualQuantity":"0.5","unit":"KGS","unitRateFc":"560","totalValueFC":"281.8","currency":"USD","unitRateINR":"42504","date":"14-Dec-2021","totalValueINR":"21252","totalValueInUsd":"281.8","indian_port":"MADRAS AIR","hs_no":"29339990","bill_no":"6670221","productDescription":"API","marketType":"REGULATED MARKET","country":"CHINA","selfForZScoreResived":"Pharma Grade","supplierPort":"N\/A","supplierAddress":"","customerAddress":"7-2-A2, HETERO CORPORATE, INDUSTRIAL ESTATE, SANATHNAGAR, Con"},{"dataSource":"API Import","activeIngredients":"","year":"2024","qtr":"Q2","strtotime":1716834600,"product":"N-ACETYL-D-LEUCINE","address":"C-8 COMMERCIAL COMPLEX","city":"NEW DELHI","supplier":"NANJING GREENWAY LIFESCIENCE ","supplierCountry":"CHINA","foreign_port":"SHANGHAI - PU DONG","customer":"SRF LIMITED","customerCountry":"INDIA","quantity":"3100.00","actualQuantity":"3100","unit":"KGS","unitRateFc":"116.5","totalValueFC":"365464.6","currency":"USD","unitRateINR":"9826.8","date":"28-May-2024","totalValueINR":"30463002.5","totalValueInUsd":"365464.6","indian_port":"Bombay Air","hs_no":"29241900","bill_no":"3704766","productDescription":"API","marketType":"REGULATED MARKET","country":"CHINA","selfForZScoreResived":"Pharma Grade","supplierPort":"SHANGHAI - PU DONG","supplierAddress":"ROOM 501 BUILDING 9TH NO. 6 JINMAROAD MAQUN QIXIA NANJING JIANGSU210049 CHINA","customerAddress":"C-8 COMMERCIAL COMPLEX"}]

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