Vitas-M small molecule compound
2,2'-{[3-(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]imino}diacetic acid
Catalog ID
STL463524
SMILES O=C(N(CC(=O)O)CC(=O)O)CCc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C
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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 C21H21NO8 MW 415.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO8/c1-10-12(3)29-16-7-17-15(6-14(10)16)11(2)13(21(28)30-17)4-5-18(23)22(8-19(24)25)9-20(26)27/h6-7H,4-5,8-9H2,1-3H3,(H,24,25)(H,26,27)InChIKey
XKJNSOWYJTZKFO-UHFFFAOYSA-NSynonyms
859137-19-22(CARBOXYMETHYL(3(235TRIMETHYL7OXOFURO(32G)CHROMEN6YL)PROPANOYL)AMINO)ACETICACID
22((3(235trimethyl7oxo7Hfuro(32g)chromen6yl)propanoyl)azanediyl)diaceticacid
22((3(235trimethyl7oxo7Hfuro(32g)chromen6yl)propanoyl)imino)diaceticacid
859137192
CC1=C(OC2=C1C=C3C(=C(C(=O)OC3=C2)CCC(=O)N(CC(=O)O)CC(=O)O)C)C
InChI=1SC21H21NO8c11012(3)291671715(614(10)16)11(2)13(21(28)3017)4518(23)22(819(24)25)920(26)27h67H4589H213H3(H2425)(H2627)
MFCD04146282
ZINC000002105518
ZINC2105518
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