Vitas-M small molecule compound

N~5~-carbamoyl-N~2~-{[5-methyl-3-(4-methylphenyl)-7-oxo-7H-furo[3,2-g]chromen-6-yl]acetyl}-L-ornithine

Catalog ID
STL532890
SMILES O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)C)N[C@H](C(=O)O)CCCNC(=O)N

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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 C27H27N3O7 MW 505.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O7/c1-14-5-7-16(8-6-14)20-13-36-22-12-23-17(10-19(20)22)15(2)18(26(34)37-23)11-24(31)30-21(25(32)33)4-3-9-29-27(28)35/h5-8,10,12-13,21H,3-4,9,11H2,1-2H3,(H,30,31)(H,32,33)(H3,28,29,35)/t21-/m0/s1
InChIKey
IRNWXCAQIUDYCF-NRFANRHFSA-N
Synonyms
956622-81-4
(2~(S))5(carbamoylamino)2((2(5methyl3(4methylphenyl)7oxofuro(32g)chromen6yl)acetyl)amino)pentanoicacid
(S)2(2(5methyl7oxo3(ptolyl)7Hfuro(32g)chromen6yl)acetamido)5ureidopentanoicacid
16406118
956622814
InChI=1SC27H27N3O7c1145716(8614)20133622122317(1019(20)22)15(2)18(26(34)3723)1124(31)3021(25(32)33)4392927(28)35h5810121321H34911H212H3(H3031)(H3233)(H3282935)t21m0s1
MFCD08002468
N~5~carbamoylN~2~((5methyl3(4methylphenyl)7oxo7Hfuro(32g)chromen6yl)acetyl)Lornithine
N5CARBAMOYLN2((5METHYL3(4METHYLPHENYL)7OXO7HFURO(32G)CHROMEN6YL)ACETYL)LORNITHINE
O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)C)N(C@H)(C(=O)O)CCCNC(=O)N
ZINC000012889115
ZINC12889115

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Available files

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