(2S)-2-[(TERT-BUTOXY)CARBONYLAMINO]-3-(4-[(3-BROMOPHENYL)METHOXY]-3-IODOPHENYL)PROPANOIC ACID

CAS No.
CCD No.
CCD00050748
Formula
C21 H23 Br I N O5
MolWeight
576.219

Basic Information

Product Name: (2S)-2-[(TERT-BUTOXY)CARBONYLAMINO]-3-(4-[(3-BROMOPHENYL)METHOXY]-3-IODOPHENYL)PROPANOIC ACID
English Synonyms: BOC-3-I-TYR(3-BRBZL)-OH ; (2S)-2-[(TERT-BUTOXY)CARBONYLAMINO]-3-(4-[(3-BROMOPHENYL)METHOXY]-3-IODOPHENYL)PROPANOIC ACID ; BOC-O-3-BROMOBENZYL-3-IODO-L-TYROSINE
MDL Number.: MFCD00080286
H bond acceptor: 6
H bond donor: 2
Smile: CC(C)(C)OC(=O)N[C@@H](Cc1ccc(c(c1)I)OCc2cccc(c2)Br)C(=O)O
InChi: InChI=1S/C21H23BrINO5/c1-21(2,3)29-20(27)24-17(19(25)26)11-13-7-8-18(16(23)10-13)28-12-14-5-4-6-15(22)9-14/h4-10,17H,11-12H2,1-3H3,(H,24,27)(H,25,26)/t17-/m0/s1
InChiKey: InChIKey=NKGXZHJJBLLHDW-KRWDZBQOSA-N

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