Vitas-M small molecule compound
[4-(6-oxo-6,7,8,9-tetrahydro-2H-cyclopenta[3,4]chromeno[8,7-e][1,3]oxazin-3(4H)-yl)phenyl]acetic acid
Catalog ID
STK885127
SMILES OC(=O)Cc1ccc(cc1)N1COc2c(C1)c1oc(=O)c3c(c1cc2)CCC3
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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 C22H19NO5 MW 377.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19NO5/c24-20(25)10-13-4-6-14(7-5-13)23-11-18-19(27-12-23)9-8-16-15-2-1-3-17(15)22(26)28-21(16)18/h4-9H,1-3,10-12H2,(H,24,25)InChIKey
IFOFQJZPLCMORM-UHFFFAOYSA-NSynonyms
(4(6oxo6789tetrahydro2Hcyclopenta(34)chromeno(87e)(13)oxazin3(4H)yl)phenyl)aceticacid
C1CC2=C(C1)C(=O)OC3=C2C=CC4=C3CN(CO4)C5=CC=C(C=C5)CC(=O)O
InChI=1SC22H19NO5c2420(25)10134614(7513)23111819(271223)98161521317(15)22(26)2821(16)18h49H131012H2(H2425)
MFCD18171981
ZINC000040486275
ZINC40486275
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