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[(2R)-N-(TERT.-BUTOXYCARBONYL)-ALPHA-METHYLASPARTYL]-BETA-(2S)-PHENYLALANYL-BETA-ALANYL-[ALPHA-METHYL-(2R)-GLUTAMYL]-GAMMA-SARCOSINE-DIESTER;ROTAMER-#2;COMPOUN
SpectraBase Compound ID BfiSn1zBC6C
InChI InChI=1S/C31H45N5O12/c1-31(2,3)48-30(45)35-22(29(44)47-6)17-24(38)34-21(16-19-10-8-7-9-11-19)27(42)32-15-14-23(37)33-20(28(43)46-5)12-13-25(39)36(4)18-26(40)41/h7-11,20-22H,12-18H2,1-6H3,(H,32,42)(H,33,37)(H,34,38)(H,35,45)(H,40,41)/t20-,21-,22+/m0/s1
InChIKey KQEWHTSWSQESPC-FDFHNCONSA-N
Mol Weight 679.7 g/mol
Molecular Formula C31H45N5O12
Exact Mass 679.306472 g/mol
Enantiomer InChIKey KQEWHTSWSQESPC-VSKRKVRLSA-N
Unknown Identification

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