Vitas-M small molecule compound
butyl 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)hexanoate (non-preferred name)
Catalog ID
STK268128
SMILES CCCCOC(=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 C28H31NO4 MW 445.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31NO4/c1-2-3-17-33-22(30)15-5-4-10-16-29-27(31)25-23-18-11-6-7-12-19(18)24(26(25)28(29)32)21-14-9-8-13-20(21)23/h6-9,11-14,23-26H,2-5,10,15-17H2,1H3InChIKey
JHEQNBXYJAKOBB-UHFFFAOYSA-NSynonyms
butyl6(1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)hexanoate(nonpreferredname)
CCCCOC(=O)CCCCCN1C(=O)C2C(C1=O)C3C4=CC=CC=C4C2C5=CC=CC=C35
InChI=1SC28H31NO4c123173322(30)155410162927(31)25231811671219(18)24(26(25)28(29)32)2114981320(21)23h6911142326H25101517H21H3
MFCD01062759
ZINC000002062950
ZINC000018246894
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