Vitas-M small molecule compound
(1-bromo-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)acetic acid (non-preferred name)
Catalog ID
STK247160
SMILES OC(=O)CN1C(=O)C2C(C1=O)C1(Br)c3c(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 C20H14BrNO4 MW 412.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14BrNO4/c21-20-12-7-3-1-5-10(12)15(11-6-2-4-8-13(11)20)16-17(20)19(26)22(18(16)25)9-14(23)24/h1-8,15-17H,9H2,(H,23,24)InChIKey
KYRBALUEXUYLGH-UHFFFAOYSA-NSynonyms
332024-29-0(1bromo1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)aceticacid(nonpreferredname)
332024290
C1=CC=C2C(=C1)C3C4C(C2(C5=CC=CC=C35)Br)C(=O)N(C4=O)CC(=O)O
InChI=1SC20H14BrNO4c212012731510(12)15(11624813(11)20)1617(20)19(26)22(18(16)25)914(23)24h181517H9H2(H2324)
MFCD01174886
ZINC000002068306
ZINC000002068309
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