Vitas-M small molecule compound
2-{[(E)-(3-nitrophenyl)methylidene]amino}strychnidin-10-one
Catalog ID
STL558114
SMILES O=C1CC2OCC=C3C4C2C2N1c1ccc(cc1C12CCN(C1C4)C3)/N=C/c1cccc(c1)[N+](=O)[O-]
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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 C28H26N4O4 MW 482.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N4O4/c33-25-13-23-26-20-12-24-28(7-8-30(24)15-17(20)6-9-36-23)21-11-18(4-5-22(21)31(25)27(26)28)29-14-16-2-1-3-19(10-16)32(34)35/h1-6,10-11,14,20,23-24,26-27H,7-9,12-13,15H2/b29-14+InChIKey
LNZBLWBXBJLXEL-IPPBACCNSA-NSynonyms
(4aR5aS)10((E)(3nitrobenzylidene)amino)4a155a788a11515aoctahydro2H46methanoindolo(321ij)oxepino(234de)pyrrolo(23h)quinolin14(4aH)one
2(((E)(3nitrophenyl)methylidene)amino)strychnidin10one
InChI=1SC28H26N4O4c332513232620122428(7830(24)1517(20)693623)211118(4522(21)31(25)27(26)28)29141621319(1016)32(34)35h161011142023242627H79121315H2b2914+
MFCD07626428
O=C1CC2OCC=C3(C@H)4C2C2N1c1ccc(cc1C12CCN((C@H)1C4)C3)N=Cc1cccc(c1)(N+)(=O)(O)
ZINC000102456856
ZINC000245226238
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