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Ornithine-Methotrexate
[CAS# 80407-73-4]

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CAS#: 80407-73-4
Product: Ornithine-Methotrexate
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Identification
Name Ornithine-Methotrexate
Synonyms (2S)-5-Amino-2-[[4-[(2,4-Diaminopteridin-6-Yl)Methyl-Methyl-Amino]Benzoyl]Amino]Pentanoic Acid; (2S)-5-Amino-2-[[[4-[(2,4-Diamino-6-Pteridinyl)Methyl-Methylamino]Phenyl]-Oxomethyl]Amino]Pentanoic Acid; (2S)-5-Amino-2-[[4-[(2,4-Diaminopteridin-6-Yl)Methyl-Methyl-Amino]Benzoyl]Amino]Valeric Acid
Molecular Structure CAS#: 80407-73-4, Ornithine-Methotrexate
Molecular Formula C20H25N9O3
Molecular Weight 439.48
CAS Registry Number 80407-73-4
SMILES [C@@H](NC(=O)C3=CC=C(N(CC2=NC1=C(N=C(N=C1N=C2)N)N)C)C=C3)(C(=O)O)CCCN
InChI 1S/C20H25N9O3/c1-29(10-12-9-24-17-15(25-12)16(22)27-20(23)28-17)13-6-4-11(5-7-13)18(30)26-14(19(31)32)3-2-8-21/h4-7,9,14H,2-3,8,10,21H2,1H3,(H,26,30)(H,31,32)(H4,22,23,24,27,28)/t14-/m0/s1
InChIKey XZMFYMLGNMSYOG-AWEZNQCLSA-N
Properties
Density 1.442g/cm3 (Cal.)
Market Analysis Reports
List of Reports Available for Ornithine-Methotrexate
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