Monochloro-monoglutathionyl melphalan
Molecular Formula:
C23H34ClN5O8S
InChI: InChI=1/C23H34ClN5O8S/c24-7-8-29(15-3-1-14(2-4-15)11-17(26)23(36)37)9-10-38-13-18(21(33)27-12-20(31)32)28-19(30)6-5-16(25)22(34)35/h1-4,16-18H,5-13,25-26H2,(H,27,33)(H,28,30)(H,31,32)(H,34,35)(H,36,37)/t16-,17?,18-/m0/s1/f/h27-28,31,34,36H
InChIKey: InChIKey=FVSFUWLXGAPZDK-SDGIEYGHDY
SMILES: C1=CC(=CC=C1CC(C(=O)O)N)N(CCSCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N)CCCl
Names:
C11603
Monochloro-monoglutathionyl melphalan
(2S)-2-amino-4-[[(1S)-2-[2-[[4-(2-amino-2-carboxy-ethyl)phenyl]-(2-chloroethyl)amino]ethylsulfanyl]-1-(carboxymethylcarbamoyl)ethyl]carbamoyl]butanoic acid
Registries:
PubChem CID 443302
PubChem ID 13768
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