Vitas-M small molecule compound
2-(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)phenyl heptanoate (non-preferred name)
Catalog ID
STK358763
SMILES CCCCCCC(=O)Oc1ccccc1N1C(=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 C31H29NO4 MW 479.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29NO4/c1-2-3-4-5-18-25(33)36-24-17-11-10-16-23(24)32-30(34)28-26-19-12-6-7-13-20(19)27(29(28)31(32)35)22-15-9-8-14-21(22)26/h6-17,26-29H,2-5,18H2,1H3InChIKey
ZPMZGBKZUKDYAP-UHFFFAOYSA-NSynonyms
2(1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)phenylheptanoate(nonpreferredname)
CCCCCCC(=O)OC1=CC=CC=C1N2C(=O)C3C(C2=O)C4C5=CC=CC=C5C3C6=CC=CC=C46
InChI=1SC31H29NO4c123451825(33)36241711101623(24)3230(34)28261912671320(19)27(29(28)31(32)35)2215981421(22)26h6172629H2518H21H3
MFCD01174402
ZINC000003666358
ZINC000018283270
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