Vitas-M small molecule compound

methyl N~2~-(tert-butoxycarbonyl)asparaginylphenylalanylphenylalaninate

Catalog ID
STK368394
SMILES COC(=O)C(NC(=O)C(NC(=O)C(NC(=O)OC(C)(C)C)CC(=O)N)Cc1ccccc1)Cc1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C28H36N4O7 MW 540.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36N4O7/c1-28(2,3)39-27(37)32-21(17-23(29)33)25(35)30-20(15-18-11-7-5-8-12-18)24(34)31-22(26(36)38-4)16-19-13-9-6-10-14-19/h5-14,20-22H,15-17H2,1-4H3,(H2,29,33)(H,30,35)(H,31,34)(H,32,37)
InChIKey
ARFLLJAVJWZYBL-UHFFFAOYSA-N
Synonyms

CC(C)(C)OC(=O)NC(CC(=O)N)C(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)OC
InChI=1SC28H36N4O7c128(23)3927(37)3221(1723(29)33)25(35)3020(1518117581218)24(34)3122(26(36)384)16191396101419h5142022H1517H214H3(H22933)(H3035)(H3134)(H3237)
METHYL2((2((4AMINO2((2METHYLPROPAN2YL)OXYCARBONYLAMINO)4OXOBUTANOYL)AMINO)3PHENYLPROPANOYL)AMINO)3PHENYLPROPANOATE
METHYL2(2(2((TERTBUTOXY)CARBONYLAMINO)3CARBAMOYLPROPANOYLAMINO)3PHENYLPROPANOYLAMINO)3PHENYLPROPANOATE
methylN~2~(tertbutoxycarbonyl)asparaginylphenylalanylphenylalaninate
METHYLN2(TERTBUTOXYCARBONYL)ASPARAGINYLPHENYLALANYLPHENYLALANINATE
MFCD00309836
ZINC000004016601
ZINC000004016604

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.