Vitas-M small molecule compound
(1S,2Z,5R,1'S,2'Z,5'R)-2,2'-{propane-1,3-diylbis[imino(1Z)eth-1-yl-1-ylidene]}bis(6,6-dimethylbicyclo[3.1.0]hexan-3-one)
Catalog ID
STL527785
SMILES C/C(=C\1/C(=O)C[C@@H]2[C@H]1C2(C)C)/NCCCN/C(=C/1\C(=O)C[C@@H]2[C@H]1C2(C)C)/C
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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 C23H34N2O2 MW 370.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H34N2O2/c1-12(18-16(26)10-14-20(18)22(14,3)4)24-8-7-9-25-13(2)19-17(27)11-15-21(19)23(15,5)6/h14-15,20-21,24-25H,7-11H2,1-6H3/b18-12+,19-13+/t14-,15-,20-,21-/m1/s1InChIKey
FBLKFIJYOFNCEN-ASSXGEMVSA-NSynonyms
956946-64-8(1~(S)2~(Z)5~(R))2(1(3(((1~(Z))1((1~(S)5~(R))66dimethyl3oxo2bicyclo(310)hexanylidene)ethyl)amino)propylamino)ethylidene)66dimethylbicyclo(310)hexan3one
(1S1S2Z2Z5R5R)22((propane13diylbis(azanediyl))bis(ethan1yl1ylidene))bis(66dimethylbicyclo(310)hexan3one)
(1S2Z5R1S2Z5R)22(propane13diylbis(imino(1Z)eth1yl1ylidene))bis(66dimethylbicyclo(310)hexan3one)
16398388
956946648
CC(=C1C(=O)C(C@@H)2(C@H)1C2(C)C)NCCCNC(=C1C(=O)C(C@@H)2(C@H)1C2(C)C)C
InChI=1SC23H34N2O2c112(1816(26)101420(18)22(143)4)248792513(2)1917(27)111521(19)23(155)6h141520212425H711H216H3b1812+1913+t14152021m1s1
MFCD03661962
ZINC000100750955
ZINC100750955
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