Vitas-M small molecule compound
4-chlorophenyl 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)cyclohexanecarboxylate (non-preferred name)
Catalog ID
STK275561
SMILES Clc1ccc(cc1)OC(=O)C1CCC(CC1)N1C(=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 C31H26ClNO4 MW 512.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26ClNO4/c32-18-11-15-20(16-12-18)37-31(36)17-9-13-19(14-10-17)33-29(34)27-25-21-5-1-2-6-22(21)26(28(27)30(33)35)24-8-4-3-7-23(24)25/h1-8,11-12,15-17,19,25-28H,9-10,13-14H2InChIKey
SOOZOZBWKRVBBT-UHFFFAOYSA-NSynonyms
4chlorophenyl4(1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)cyclohexanecarboxylate(nonpreferredname)
C1CC(CCC1C(=O)OC2=CC=C(C=C2)Cl)N3C(=O)C4C(C3=O)C5C6=CC=CC=C6C4C7=CC=CC=C57
InChI=1SC31H26ClNO4c3218111520(161218)3731(36)1791319(141017)3329(34)272521512622(21)26(28(27)30(33)35)24843723(24)25h1811121517192528H9101314H2
MFCD03037734
ZINC000001458766
ZINC000018148974
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