Vitas-M small molecule compound

N-(6-{[3-(5-methyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanoyl]amino}hexanoyl)-L-phenylalanine

Catalog ID
STL529550
SMILES O=C(CCc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccccc1)NCCCCCC(=O)N[C@H](C(=O)O)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 C36H36N2O7 MW 608.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H36N2O7/c1-23-26(36(43)45-32-21-31-28(20-27(23)32)29(22-44-31)25-13-7-3-8-14-25)16-17-33(39)37-18-10-4-9-15-34(40)38-30(35(41)42)19-24-11-5-2-6-12-24/h2-3,5-8,11-14,20-22,30H,4,9-10,15-19H2,1H3,(H,37,39)(H,38,40)(H,41,42)/t30-/m0/s1
InChIKey
GBNYVWKMSCWWQK-PMERELPUSA-N
Synonyms
956947-35-6
(2~(S))2(6(3(5methyl7oxo3phenylfuro(32g)chromen6yl)propanoylamino)hexanoylamino)3phenylpropanoicacid
(S)2(6(3(5methyl7oxo3phenyl7Hfuro(32g)chromen6yl)propanamido)hexanamido)3phenylpropanoicacid
16406083
956947356
InChI=1SC36H36N2O7c12326(36(43)4532213128(2027(23)32)29(224431)25137381425)161733(39)371810491534(40)3830(35(41)42)1924115261224h23581114202230H49101519H21H3(H3739)(H3840)(H4142)t30m0s1
MFCD08002463
N(6((3(5methyl7oxo3phenyl7Hfuro(32g)chromen6yl)propanoyl)amino)hexanoyl)Lphenylalanine
O=C(CCc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccccc1)NCCCCCC(=O)N(C@H)(C(=O)O)Cc1ccccc1
ZINC000070706844
ZINC70706844

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Available files

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