Vitas-M small molecule compound
4-({[6-(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)hexanoyl]oxy}acetyl)phenyl 3-methoxybenzoate (non-preferred name)
Catalog ID
STK286798
SMILES COc1cccc(c1)C(=O)Oc1ccc(cc1)C(=O)COC(=O)CCCCCN1C(=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 C40H35NO8 MW 657.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C40H35NO8/c1-47-27-11-9-10-25(22-27)40(46)49-26-19-17-24(18-20-26)32(42)23-48-33(43)16-3-2-8-21-41-38(44)36-34-28-12-4-5-13-29(28)35(37(36)39(41)45)31-15-7-6-14-30(31)34/h4-7,9-15,17-20,22,34-37H,2-3,8,16,21,23H2,1H3InChIKey
YDIGBIWGRRRAMO-UHFFFAOYSA-NSynonyms
4(((6(1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)hexanoyl)oxy)acetyl)phenyl3methoxybenzoate(nonpreferredname)
COC1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)C(=O)COC(=O)CCCCCN3C(=O)C4C(C3=O)C5C6=CC=CC=C6C4C7=CC=CC=C57
InChI=1SC40H35NO8c147271191025(2227)40(46)4926191724(182026)32(42)234833(43)16328214138(44)36342812451329(28)35(37(36)39(41)45)3115761430(31)34h479151720223437H238162123H21H3
MFCD03900827
ZINC000097949178
ZINC000097949180
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