Vitas-M small molecule compound
methyl 4-{[(16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)acetyl]oxy}benzoate (non-preferred name)
Catalog ID
STK286489
SMILES COC(=O)c1ccc(cc1)OC(=O)CN1C(=O)C2C(C1=O)C1c3c(C2c2c1cccc2)cccc3
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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 C28H21NO6 MW 467.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21NO6/c1-34-28(33)15-10-12-16(13-11-15)35-21(30)14-29-26(31)24-22-17-6-2-3-7-18(17)23(25(24)27(29)32)20-9-5-4-8-19(20)22/h2-13,22-25H,14H2,1H3InChIKey
WRHTWFUZCLDJPI-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC=C(C=C1)OC(=O)CN2C(=O)C3C(C2=O)C4C5=CC=CC=C5C3C6=CC=CC=C46
InChI=1SC28H21NO6c13428(33)15101216(131115)3521(30)142926(31)242217623718(17)23(25(24)27(29)32)20954819(20)22h2132225H14H21H3
methyl4(((1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)acetyl)oxy)benzoate(nonpreferredname)
MFCD03577059
ZINC000009371819
ZINC000017988210
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Check stock on Vitas-MAvailable files
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