Vitas-M small molecule compound
7-hydroxy-5-methoxy-6-{(2E)-6-[4-(4-methoxyphenyl)piperazin-1-yl]-3-methyl-6-oxohex-2-en-1-yl}-4-methyl-2-benzofuran-1(3H)-one
Catalog ID
STL522399
SMILES COc1c(C/C=C(/CCC(=O)N2CCN(CC2)c2ccc(cc2)OC)\C)c(O)c2c(c1C)COC2=O
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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 C28H34N2O6 MW 494.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34N2O6/c1-18(5-11-22-26(32)25-23(17-36-28(25)33)19(2)27(22)35-4)6-12-24(31)30-15-13-29(14-16-30)20-7-9-21(34-3)10-8-20/h5,7-10,32H,6,11-17H2,1-4H3/b18-5+InChIKey
LRXYEHWAOUJZLP-BLLMUTORSA-NSynonyms
1630908-14-3(E)7HYDROXY5METHOXY6(6(4(4METHOXYPHENYL)PIPERAZIN1YL)3METHYL6OXOHEX2EN1YL)4METHYLISOBENZOFURAN1(3H)ONE
1630908143
7hydroxy5methoxy6((~(E))6(4(4methoxyphenyl)piperazin1yl)3methyl6oxohex2enyl)4methyl3~(H)2benzofuran1one
7hydroxy5methoxy6((2E)6(4(4methoxyphenyl)piperazin1yl)3methyl6oxohex2en1yl)4methyl2benzofuran1(3H)one
91636450
COc1c(CC=C(CCC(=O)N2CCN(CC2)c2ccc(cc2)OC)C)c(O)c2c(c1C)COC2=O
InChI=1SC28H34N2O6c118(5112226(32)2523(173628(25)33)19(2)27(22)354)61224(31)30151329(141630)207921(343)10820h571032H61117H214H3b185+
MFCD28348713
ZINC000217593502
ZINC217593502
Check stock
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