Vitas-M small molecule compound

N-[(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]glycylglycyl-4-chlorophenylalanine

Catalog ID
STL464132
SMILES O=C(NCC(=O)NC(C(=O)O)Cc1ccc(cc1)Cl)CNC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1C

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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 C29H28ClN3O8 MW 582.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28ClN3O8/c1-14-13-40-26-16(3)27-20(9-19(14)26)15(2)21(29(39)41-27)10-23(34)31-11-24(35)32-12-25(36)33-22(28(37)38)8-17-4-6-18(30)7-5-17/h4-7,9,13,22H,8,10-12H2,1-3H3,(H,31,34)(H,32,35)(H,33,36)(H,37,38)
InChIKey
CYYKUKSEFQOISX-UHFFFAOYSA-N
Synonyms
1214702-00-7
1214702007
3(4chlorophenyl)2((2((2((2(359trimethyl7oxofuro(32g)chromen6yl)acetyl)amino)acetyl)amino)acetyl)amino)propanoicacid
3(4chlorophenyl)2(2(2(2(359trimethyl7oxo7Hfuro(32g)chromen6yl)acetamido)acetamido)acetamido)propanoicacid
CC1=COC2=C(C3=C(C=C12)C(=C(C(=O)O3)CC(=O)NCC(=O)NCC(=O)NC(CC4=CC=C(C=C4)Cl)C(=O)O)C)C
InChI=1SC29H28ClN3O8c11413402616(3)2720(919(14)26)15(2)21(29(39)4127)1023(34)311124(35)321225(36)3322(28(37)38)8174618(30)7517h4791322H81012H213H3(H3134)(H3235)(H3336)(H3738)
MFCD07209526
N((359trimethyl7oxo7Hfuro(32g)chromen6yl)acetyl)glycylglycyl4chlorophenylalanine
ZINC000070704916
ZINC000070704920

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Available files

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