Vitas-M small molecule compound
N-[(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]-beta-alanine
Catalog ID
STL463958
SMILES O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2)NCCC(=O)O
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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 C21H21NO6 MW 383.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO6/c1-11-13-8-15-12-4-2-3-5-16(12)27-18(15)10-17(13)28-21(26)14(11)9-19(23)22-7-6-20(24)25/h8,10H,2-7,9H2,1H3,(H,22,23)(H,24,25)InChIKey
AEVSEJRAHLUEDG-UHFFFAOYSA-NSynonyms
858765-27-23((2(4methyl2oxo6789tetrahydro(1)benzofuro(32g)chromen3yl)acetyl)amino)propanoicacid
3(2(4methyl2oxo6789tetrahydro2Hbenzofuro(32g)chromen3yl)acetamido)propanoicacid
858765272
CC1=C(C(=O)OC2=C1C=C3C4=C(CCCC4)OC3=C2)CC(=O)NCCC(=O)O
InChI=1SC21H21NO6c1111381512423516(12)2718(15)1017(13)2821(26)14(11)919(23)227620(24)25h810H279H21H3(H2223)(H2425)
MFCD04144717
N((4methyl2oxo6789tetrahydro2H(1)benzofuro(32g)chromen3yl)acetyl)betaalanine
ZINC000002102349
ZINC2102349
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