Vitas-M small molecule compound
2-(3-methoxyphenyl)-2-oxoethyl 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)propanoate (non-preferred name)
Catalog ID
STK274672
SMILES COc1cccc(c1)C(=O)COC(=O)C(N1C(=O)C2C(C1=O)C1c3c(C2c2c1cccc2)cccc3)C
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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 C30H25NO6 MW 495.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25NO6/c1-16(30(35)37-15-23(32)17-8-7-9-18(14-17)36-2)31-28(33)26-24-19-10-3-4-11-20(19)25(27(26)29(31)34)22-13-6-5-12-21(22)24/h3-14,16,24-27H,15H2,1-2H3InChIKey
XPMIZQLTCDRIFE-UHFFFAOYSA-NSynonyms
2(3methoxyphenyl)2oxoethyl2(1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)propanoate(nonpreferredname)
CC(C(=O)OCC(=O)C1=CC(=CC=C1)OC)N2C(=O)C3C(C2=O)C4C5=CC=CC=C5C3C6=CC=CC=C46
InChI=1SC30H25NO6c116(30(35)371523(32)1787918(1417)362)3128(33)26241910341120(19)25(27(26)29(31)34)2213651221(22)24h314162427H15H212H3
MFCD03070645
ZINC000009371468
ZINC000018098023
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