Vitas-M small molecule compound
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)phenyl octanoate (non-preferred name)
Catalog ID
STK247526
SMILES CCCCCCCC(=O)Oc1ccccc1N1C(=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 C32H31NO4 MW 493.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31NO4/c1-2-3-4-5-6-19-26(34)37-25-18-12-11-17-24(25)33-31(35)29-27-20-13-7-8-14-21(20)28(30(29)32(33)36)23-16-10-9-15-22(23)27/h7-18,27-30H,2-6,19H2,1H3InChIKey
QDIGAFPYTPRXCW-UHFFFAOYSA-NSynonyms
2(1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)phenyloctanoate(nonpreferredname)
CCCCCCCC(=O)OC1=CC=CC=C1N2C(=O)C3C(C2=O)C4C5=CC=CC=C5C3C6=CC=CC=C46
InChI=1SC32H31NO4c1234561926(34)37251812111724(25)3331(35)29272013781421(20)28(30(29)32(33)36)23161091522(23)27h7182730H2619H21H3
MFCD01174403
ZINC000003666361
ZINC000003666363
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