Vitas-M small molecule compound
1-(hydroxymethyl)-17-(4-iodo-2-methylphenyl)-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione (non-preferred name)
Catalog ID
STK523964
SMILES OCC12C3C(=O)N(C(=O)C3C(c3c1cccc3)c1c2cccc1)c1ccc(cc1C)I
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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 C26H20INO3 MW 521.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20INO3/c1-14-12-15(27)10-11-20(14)28-24(30)22-21-16-6-2-4-8-18(16)26(13-29,23(22)25(28)31)19-9-5-3-7-17(19)21/h2-12,21-23,29H,13H2,1H3InChIKey
ZGPOKZMJMOJFCI-UHFFFAOYSA-NSynonyms
1(hydroxymethyl)17(4iodo2methylphenyl)17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
CC1=C(C=CC(=C1)I)N2C(=O)C3C4C5=CC=CC=C5C(C3C2=O)(C6=CC=CC=C46)CO
InChI=1SC26H20INO3c1141215(27)101120(14)2824(30)222116624818(16)26(132923(22)25(28)31)19953717(19)21h212212329H13H21H3
MFCD01070727
ZINC000000706257
ZINC000000706260
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