Vitas-M small molecule compound
N-(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)tricyclo[3.3.1.1~3,7~]decane-1-carboxamide (non-preferred name)
Catalog ID
STK710027
SMILES O=C(C12CC3CC(C2)CC(C1)C3)NN1C(=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 C29H28N2O3 MW 452.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N2O3/c32-26-24-22-18-5-1-2-6-19(18)23(21-8-4-3-7-20(21)22)25(24)27(33)31(26)30-28(34)29-12-15-9-16(13-29)11-17(10-15)14-29/h1-8,15-17,22-25H,9-14H2,(H,30,34)InChIKey
QQZQZWVJAQTINL-UHFFFAOYSA-NSynonyms
C1C2CC3CC1CC(C2)(C3)C(=O)NN4C(=O)C5C(C4=O)C6C7=CC=CC=C7C5C8=CC=CC=C68
InChI=1SC29H28N2O3c3226242218512619(18)23(21843720(21)22)25(24)27(33)31(26)3028(34)291215916(1329)1117(1015)1429h1815172225H914H2(H3034)
MFCD02042458
N(1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)tricyclo(3311~37~)decane1carboxamide(nonpreferredname)
ZINC000008989987
ZINC000018280919
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