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Acein acetate

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Acein acetate is a high-affinity angiotensin-converting enzyme (ACE) ligand with a Kd of 2.79 nM. It potentiates NMDA+ D-serine-induced dopamine release from the striatum in vivo and striatal slices in vitro.

Category

Peptide Inhibitors

Catalog number

BAT-016395

Molecular Formula

C45H72N10O15

Molecular Weight

993.11

Specification

IUPAC Name

acetic acid;(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S,3R)-3-hydroxy-2-[[(2S,3R)-3-hydroxy-2-[[(2S,3R)-3-hydroxy-2-[[(2S)-1-[(2S)-pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]butanoyl]amino]butanoyl]amino]butanoyl]amino]hexanoyl]amino]-3-phenylpropanoyl]amino]propanoyl]amino]propanoic acid

Synonyms

H-Pro-Pro-Thr-Thr-Thr-Lys-Phe-Ala-Ala-OH.CH3CO2H; L-prolyl-L-prolyl-L-threonyl-L-threonyl-L-threonyl-L-lysyl-L-phenylalanyl-L-alanyl-L-alanine acetate

Related CAS

2022202-76-0 (free base)

Purity

≥95%

Sequence

PPTTTKFAA.CH3CO2H

Storage

Store at -20°C

InChI

InChI=1S/C43H68N10O13.C2H4O2/c1-22(35(57)47-23(2)43(65)66)46-37(59)30(21-27-13-7-6-8-14-27)49-36(58)28(15-9-10-18-44)48-39(61)32(24(3)54)51-41(63)34(26(5)56)52-40(62)33(25(4)55)50-38(60)31-17-12-20-53(31)42(64)29-16-11-19-45-29;1-2(3)4/h6-8,13-14,22-26,28-34,45,54-56H,9-12,15-21,44H2,1-5H3,(H,46,59)(H,47,57)(H,48,61)(H,49,58)(H,50,60)(H,51,63)(H,52,62)(H,65,66);1H3,(H,3,4)/t22-,23-,24+,25+,26+,28-,29-,30-,31-,32-,33-,34-;/m0./s1

InChI Key

QHTMYUPZOJIJLS-VEVAGVRESA-N

Canonical SMILES

CC(C(C(=O)NC(C(C)O)C(=O)NC(C(C)O)C(=O)NC(CCCCN)C(=O)NC(CC1=CC=CC=C1)C(=O)NC(C)C(=O)NC(C)C(=O)O)NC(=O)C2CCCN2C(=O)C3CCCN3)O.CC(=O)O