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    Technical details about MMAF, learn more about the structure, uses, toxicity, action, side effects and more

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    MMAF

    PharmaCompass

    Farmhispania Group, a leading European CDMO in HPAPI Technologies & High Potency Fermentation.

    One Pharma aims to be one of the leading generic companies in Europe.

    2D Structure
    1. Also known as: 745017-94-1, Monomethylauristatin f, Monomethyl auristatin f, (2s)-2-[[(2r,3r)-3-methoxy-3-[(2s)-1-[(3r,4s,5s)-3-methoxy-5-methyl-4-[methyl-[(2s)-3-methyl-2-[[(2s)-3-methyl-2-(methylamino)butanoyl]amino]butanoyl]amino]heptanoyl]pyrrolidin-2-yl]-2-methylpropanoyl]amino]-3-phenylpropanoic acid, 1z1ai9iw5l, Monomethylauristatinf
    Molecular Formula
    C39H65N5O8
    Molecular Weight
    732.0  g/mol
    InChI Key
    MFRNYXJJRJQHNW-DEMKXPNLSA-N
    FDA UNII
    1Z1AI9IW5L
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (2S)-2-[[(2R,3R)-3-methoxy-3-[(2S)-1-[(3R,4S,5S)-3-methoxy-5-methyl-4-[methyl-[(2S)-3-methyl-2-[[(2S)-3-methyl-2-(methylamino)butanoyl]amino]butanoyl]amino]heptanoyl]pyrrolidin-2-yl]-2-methylpropanoyl]amino]-3-phenylpropanoic acid
    2.1.2 InChI
    InChI=1S/C39H65N5O8/c1-12-25(6)34(43(9)38(48)33(24(4)5)42-37(47)32(40-8)23(2)3)30(51-10)22-31(45)44-20-16-19-29(44)35(52-11)26(7)36(46)41-28(39(49)50)21-27-17-14-13-15-18-27/h13-15,17-18,23-26,28-30,32-35,40H,12,16,19-22H2,1-11H3,(H,41,46)(H,42,47)(H,49,50)/t25-,26+,28-,29-,30+,32-,33-,34-,35+/m0/s1
    2.1.3 InChI Key
    MFRNYXJJRJQHNW-DEMKXPNLSA-N
    2.1.4 Canonical SMILES
    CCC(C)C(C(CC(=O)N1CCCC1C(C(C)C(=O)NC(CC2=CC=CC=C2)C(=O)O)OC)OC)N(C)C(=O)C(C(C)C)NC(=O)C(C(C)C)NC
    2.1.5 Isomeric SMILES
    CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@@H]([C@@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O)OC)OC)N(C)C(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC
    2.2 Other Identifiers
    2.2.1 UNII
    1Z1AI9IW5L
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Mmaf Peptide

    2. Monomethyl Auristatin F

    3. Monomethylauristatin F

    2.3.2 Depositor-Supplied Synonyms

    1. 745017-94-1

    2. Monomethylauristatin F

    3. Monomethyl Auristatin F

    4. (2s)-2-[[(2r,3r)-3-methoxy-3-[(2s)-1-[(3r,4s,5s)-3-methoxy-5-methyl-4-[methyl-[(2s)-3-methyl-2-[[(2s)-3-methyl-2-(methylamino)butanoyl]amino]butanoyl]amino]heptanoyl]pyrrolidin-2-yl]-2-methylpropanoyl]amino]-3-phenylpropanoic Acid

    5. 1z1ai9iw5l

    6. Monomethylauristatinf

    7. (2~{s})-2-[[(2~{r},3~{r})-3-methoxy-3-[(2~{s})-1-[(3~{r},4~{s},5~{s})-3-methoxy-5-methyl-4-[methyl-[(2~{s})-3-methyl-2-[[(2~{s})-3-methyl-2-(methylamino)butanoyl]amino]butanoyl]amino]heptanoyl]pyrrolidin-2-yl]-2-methyl-propanoyl]amino]-3-phenyl-propanoic Acid

    8. Schembl3208014

    9. Chembl3359822

    10. Monomethyl Auristatin F (mmaf)

    11. Dtxsid601031563

    12. (2s)-2-[[(2r,3r)-3-methoxy-3-[(2s)-1-[(3r,5s)-3-methoxy-5-methyl-4-[methyl-[(2s)-3-methyl-2-[[(2s)-3-methyl-2-(methylamino)butanoyl]amino]butanoyl]amino]heptanoyl]pyrrolidin-2-yl]-2-methylpropanoyl]amino]-3-phenylpropanoic Acid

    13. Amy30768

    14. Ex-a1046

    15. Mfcd25976742

    16. Zinc167866935

    17. Monomethylauristatin Phenylalanine

    18. Ac-30596

    19. Bp-22316

    20. Hy-15579

    21. Db-094829

    22. (s)-2-((2r,3r)-3-((s)-1-((3r,4s,5s)-4-((s)-n,3-dimethyl-2-((s)-3-methyl-2-(methylamino)butanamido)butanamido)-3-methoxy-5-methylheptanoyl)pyrrolidin-2-yl)-3-methoxy-2-methylpropanamido)-3-phenylpropanoic Acid

    23. L-phenylalanine, N-methyl-l-valyl-l-valyl-(3r,4s,5s)-3-methoxy-5-methyl-4-(methylamino)heptanoyl-(.alpha.r,.beta.r,2s)-.beta.-methoxy-.alpha.-methyl-2-pyrrolidinepropanoyl-

    2.4 Create Date
    2006-10-25
    3 Chemical and Physical Properties
    Molecular Weight 732.0 g/mol
    Molecular Formula C39H65N5O8
    XLogP32.1
    Hydrogen Bond Donor Count4
    Hydrogen Bond Acceptor Count9
    Rotatable Bond Count21
    Exact Mass731.48331405 g/mol
    Monoisotopic Mass731.48331405 g/mol
    Topological Polar Surface Area167 Ų
    Heavy Atom Count52
    Formal Charge0
    Complexity1160
    Isotope Atom Count0
    Defined Atom Stereocenter Count9
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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