Vitas-M small molecule compound

methyl N~6~-[(benzyloxy)carbonyl]lysylalanylphenylalanylphenylalaninate

Catalog ID
STK370524
SMILES COC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(CCCCNC(=O)OCc1ccccc1)N)C)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 C36H45N5O7 MW 659.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H45N5O7/c1-25(39-33(43)29(37)20-12-13-21-38-36(46)48-24-28-18-10-5-11-19-28)32(42)40-30(22-26-14-6-3-7-15-26)34(44)41-31(35(45)47-2)23-27-16-8-4-9-17-27/h3-11,14-19,25,29-31H,12-13,20-24,37H2,1-2H3,(H,38,46)(H,39,43)(H,40,42)(H,41,44)
InChIKey
RMRQGSRUGRBWCV-UHFFFAOYSA-N
Synonyms

CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)OC)NC(=O)C(CCCCNC(=O)OCC3=CC=CC=C3)N
InChI=1SC36H45N5O7c125(3933(43)29(37)201213213836(46)48242818105111928)32(42)4030(2226146371526)34(44)4131(35(45)472)2327168491727h3111419252931H1213202437H212H3(H3846)(H3943)(H4042)(H4144)
METHYL2((2(2((2AMINO6(PHENYLMETHOXYCARBONYLAMINO)HEXANOYL)AMINO)PROPANOYLAMINO)3PHENYLPROPANOYL)AMINO)3PHENYLPROPANOATE
methylN~6~((benzyloxy)carbonyl)lysylalanylphenylalanylphenylalaninate
METHYLN6((BENZYLOXY)CARBONYL)LYSYLALANYLPHENYLALANYLPHENYLALANINATE
MFCD00688061
ZINC000004016998
ZINC000245327818

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Available files

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