Vitas-M small molecule compound
17-(1,3-benzodioxol-5-yl)-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-1-carbaldehyde (non-preferred name)
Catalog ID
STK264412
SMILES O=CC12C3C(=O)N(C(=O)C3C(c3c1cccc3)c1c2cccc1)c1ccc2c(c1)OCO2
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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 C26H17NO5 MW 423.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H17NO5/c28-12-26-17-7-3-1-5-15(17)21(16-6-2-4-8-18(16)26)22-23(26)25(30)27(24(22)29)14-9-10-19-20(11-14)32-13-31-19/h1-12,21-23H,13H2InChIKey
VRLKODFHMHKDIM-UHFFFAOYSA-NSynonyms
17(13benzodioxol5yl)1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1carbaldehyde(nonpreferredname)
C1OC2=C(O1)C=C(C=C2)N3C(=O)C4C5C6=CC=CC=C6C(C4C3=O)(C7=CC=CC=C57)C=O
InChI=1SC26H17NO5c28122617731515(17)21(16624818(16)26)2223(26)25(30)27(24(22)29)149101920(1114)32133119h1122123H13H2
MFCD01465225
ZINC000000707247
ZINC000000707250
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