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B581 TRIFLUOROACETATE

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Name: B581 TRIFLUOROACETATE
CAS: 149759-96-6
Synonyms: N-[2(S)-(2(R)-2-AMINO-3-MERCAPTOPROPYLAMINO)-3-METHYLBUTYL]-L-PHENYLALANYL-L-METHIONINE TRIFLUOROACETATE SALT ; B581 TRIFLUOROACETATE SALT ; B581 TRIFLUOROACETATE ; N-[(S)-2-((R)-2-AMINO-3-MERCAPTO-PROPYLAMINO)-3-METHYL-BUTYL]-PHE-MET-OH TRIFLUOROACETATE ; H-CYS-((R))-VAL-((R))-PHE-MET-OH TRIFLUOROACETATE ; H-CYS-(?)-VAL-(?)-PHE-MET-OH ; CYS-(R)-VAL-(R)-PHE-MET
MDL.: MFCD18910841
H bond acceptor: 7
H bond donor: 5
Smile: CC(C)[C@@H](CN[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCSC)C(=O)O)NC[C@H](CS)N.C(=O)(C(F)(F)F)O
InChi: InChI=1S/C22H38N4O3S2.C2HF3O2/c1-15(2)20(24-12-17(23)14-30)13-25-19(11-16-7-5-4-6-8-16)21(27)26-18(22(28)29)9-10-31-3;3-2(4,5)1(6)7/h4-8,15,17-20,24-25,30H,9-14,23H2,1-3H3,(H,26,27)(H,28,29);(H,6,7)/t17-,18+,19+,20-;/m1./s1
InChiKey: InChIKey=SRWYVRMTWKRCBF-GCGMKQBYSA-N

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