Acetic acid;(2S)-2-amino-N-[(1R)-1-[[[(1S)-1-(2-hydroxyethylcarbamoyl)-2-phenyl-ethyl]-methyl-carbamoyl]methylcarbamoyl]ethyl]-3-(4-hydroxyphenyl)propanamide

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CAS
100929-53-1
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Purity
96%
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Catalog Number

ACM100929531

Product Name

Acetic acid;(2S)-2-amino-N-[(1R)-1-[[[(1S)-1-(2-hydroxyethylcarbamoyl)-2-phenyl-ethyl]-methyl-carbamoyl]methylcarbamoyl]ethyl]-3-(4-hydroxyphenyl)propanamide

Structure

CAS

100929-53-1

Category

Heterocyclic Organic Compound

Synonyms

ACMC-20m3za, 100929-53-1, acetic acid; (2S)-2-amino-N-[(1R)-1-[[[(1S)-1-(2-hydroxyethylcarbamoyl)-2-phenyl-ethyl]-methyl-carbamoyl]methylcarbamoyl]ethyl]-3-(4-hydroxyphenyl)propanamide

IUPAC Name

acetic acid;2-amino-N-[1-[[2-[[1-(2-hydroxyethylamino)-1-oxo-3-phenylpropan-2-yl]-methylamino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-3-(4-hydroxyphenyl)propanamide

Molecular Weight

573.64

Molecular Formula

C₂₈H₃₉N₅O₈

Canonical SMILES

CC(C(=O)NCC(=O)N(C)C(CC1=CC=CC=C1)C(=O)NCCO)NC(=O)C(CC2=CC=C(C=C2)O)N.CC(=O)O

InChI Key

XZZYKCKUDLGXJA-UHFFFAOYSA-N

Boiling Point

922.7ºC at 760mmHg

Flash Point

511.8ºC