Analyte Name

EMPA-Nonapeptide

Molecular Formula

C36 H56 N9 O16 P

Molecular Weight

901.854

Accurate Mass

901.358

SMILES

CCOP(=O)(C)OC[C@H](NC(=O)C(CCC(=O)O)NC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](CO)C(=O)O

InChI

InChI=1S/C36H56N9O16P/c1-6-60-62(5,59)61-18-26(45-34(55)24(12-13-29(49)50)43-28(48)16-39-33(54)23(37)14-22-10-8-7-9-11-22)35(56)42-19(2)30(51)38-15-27(47)40-20(3)31(52)41-21(4)32(53)44-25(17-46)36(57)58/h7-11,19-21,23-26,46H,6,12-18,37H2,1-5H3,(H,38,51)(H,39,54)(H,40,47)(H,41,52)(H,42,56)(H,43,48)(H,44,53)(H,45,55)(H,49,50)(H,57,58)/t19-,20-,21-,23-,24?,25+,26-,62?/m0/s1

IUPAC

4-[[2-[[(2S)-2-amino-3-phenylpropanoyl]amino]acetyl]amino]-5-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-[[(1R)-1-carboxy-2-hydroxyethyl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-3-[ethoxy(methyl)phosphoryl]oxy-1-oxopropan-2-yl]amino]-5-oxopentanoic acid

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat