Vitas-M small molecule compound
5-bromo-3-(6,6-dimethyl-4-oxotetrahydro-2H-pyran-3-yl)-3-hydroxy-1-propyl-1,3-dihydro-2H-indol-2-one
Catalog ID
STK972947
SMILES CCCN1c2ccc(cc2C(C1=O)(O)C1COC(CC1=O)(C)C)Br
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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 C18H22BrNO4 MW 396.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22BrNO4/c1-4-7-20-14-6-5-11(19)8-12(14)18(23,16(20)22)13-10-24-17(2,3)9-15(13)21/h5-6,8,13,23H,4,7,9-10H2,1-3H3InChIKey
MSPZCHQDXXVZOI-UHFFFAOYSA-NSynonyms
5BROMO3(66DIMETHYL4OXOOXAN3YL)3HYDROXY1PROPYLINDOL2ONE
5bromo3(66dimethyl4oxotetrahydro2Hpyran3yl)3hydroxy1propyl13dihydro2Hindol2one
CCCN1C2=C(C=C(C=C2)Br)C(C1=O)(C3COC(CC3=O)(C)C)O
InChI=1SC18H22BrNO4c14720146511(19)812(14)18(2316(20)22)13102417(23)915(13)21h5681323H47910H213H3
MFCD06136957
ZINC000005274378
ZINC000005274381
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