(3S,6S,12S)-12-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-6-benzyl-13,13-dimethyl-5,8,11-trioxo-1-thia-4,7,10-triazacyclotridecane-3-carboxylic acid msds| properties| cas no| molecular formula | WorldOfChemicals

(3S,6S,12S)-12-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-6-benzyl-13,13-dimethyl-5,8,11-trioxo-1-thia-4,7,10-triazacyclotridecane-3-carboxylic acid Properties

(3S,6S,12S)-12-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-6-benzyl-13,13-dimethyl-5,8,11-trioxo-1-thia-4,7,10-triazacyclotridecane-3-carboxylic acid

Molecule Structure Image

Description

 

Chemical Properties

IUPAC Name (3S,6S,12S)-6-Benzyl-13,13-dimethyl-5,8,11-trioxo-12-(L-tyrosylamino)-1-thia-4,7,10-triazacyclotridecane-3-carboxylic acid
InChI 1S/C28H35N5O7S/c1-28(2)23(33-24(36)19(29)12-17-8-10-18(34)11-9-17)26(38)30-14-22(35)31-20(13-16-6-4-3-5-7-16)25(37)32-21(15-41-28)27(39)40/h3-11,19-21,23,34H,12-15,29H2,1-2H3,(H,30,38)(H,31,35)(H,32,37)(H,33,36)(H,39,40)/t19-,20-,21+,23-/m0/s1
InChIKey YTIQLGJTYUBFNI-QXUYBEEESA-N
Molar Mass 585.67 g/mol
Molecular Formula C28H35N5O7S
Refractive 1.651 n/D