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依达曲沙
Edatrexate
N-(4-(1-((2,4-二氨基-6-蝶啶)甲基)丙基)苯甲酰)-L-谷氨酸, 10-EdAM, 10-ethyl-10-deazaaminopterin, EDATREXATE
CAS号: 80576-83-6
IUPAC名称: (2S)-2-[[4-[1-(2,4-diaminopteridin-6-yl)butan-2-yl]benzoyl]amino]pentanedioic acid
分子式: C22H25N7O5
分子量: 467.47800
InChI: InChI=1S/C22H25N7O5/c1-2-11(9-14-10-25-19-17(26-14)18(23)28-22(24)29-19)12-3-5-13(6-4-12)20(32)27-15(21(33)34)7-8-16(30)31/h3-6,10-11,15H,2,7-9H2,1H3,(H,27,32)(H,30,31)(H,33,34)(H4,23,24,25,28,29)/t11?,15-/m0/s1
InChIKey: FSIRXIHZBIXHKT-MHTVFEQDSA-N
SMILES: -
EINECS: CCC(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)O)C(=O)O
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