Vitas-M small molecule compound
{(2E)-2-benzylidene-4-oxo-7-phenyl-6-[(triphenylphosphonio)methyl]hept-6-en-1-yl}(triphenyl)phosphonium
Catalog ID
STL043282
SMILES O=C(C/C(=C\c1ccccc1)/C[P+](c1ccccc1)(c1ccccc1)c1ccccc1)C/C(=C\c1ccccc1)/C[P+](c1ccccc1)(c1ccccc1)c1ccccc1
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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 C57H50OP2 MW 812.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C57H50OP2/c58-51(43-49(41-47-25-9-1-10-26-47)45-59(52-29-13-3-14-30-52,53-31-15-4-16-32-53)54-33-17-5-18-34-54)44-50(42-48-27-11-2-12-28-48)46-60(55-35-19-6-20-36-55,56-37-21-7-22-38-56)57-39-23-8-24-40-57/h1-42H,43-46H2/q+2/b49-41+,50-42+InChIKey
TZPYVXIPRUHANZ-NTHXEYRTSA-NSynonyms
((2E)2benzylidene4oxo7phenyl6((triphenylphosphonio)methyl)hept6en1yl)(triphenyl)phosphonium
((2E6E)26dibenzylidene4oxoheptane17diyl)bis(triphenylphosphonium)bromide
((E2E)2BENZYLIDENE4OXO7PHENYL6(TRIPHENYLPHOSPHANIUMYLMETHYL)HEPT6ENYL)TRIPHENYLPHOSPHANIUM
C1=CC=C(C=C1)C=C(CC(=O)CC(=CC2=CC=CC=C2)C(P+)(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C(P+)(C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8
InChI=1SC57H50OP2c5851(4349(41472591102647)4559(52291331430525331154163253)5433175183454)4450(424827112122848)4660(55351962036555637217223856)5739238244057h142H4346H2q+2b4941+5042+
O=C(CC(=Cc1ccccc1)C(P+)(c1ccccc1)(c1ccccc1)c1ccccc1)CC(=Cc1ccccc1)C(P+)(c1ccccc1)(c1ccccc1)c1ccccc1
O=C(CC(=Cc1ccccc1)C(P+)(c1ccccc1)(c1ccccc1)c1ccccc1)CC(=Cc1ccccc1)C(P+)(c1ccccc1)(c1ccccc1)c1ccccc1(Br)(Br)
ZINC000097969390
ZINC97969390
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