Vitas-M small molecule compound
(1S,2Z,5R)-6,6-dimethyl-2-[1-({1-[(2R)-octahydro-1H-2,5-methanoinden-4-yl]ethyl}amino)ethylidene]bicyclo[3.1.0]hexan-3-one
Catalog ID
STL562695
SMILES CC(C1C2CCC3C1CC(C2)C3)N/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 C22H33NO MW 327.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H33NO/c1-11(19-15-6-5-14-7-13(8-15)9-16(14)19)23-12(2)20-18(24)10-17-21(20)22(17,3)4/h11,13-17,19,21,23H,5-10H2,1-4H3/b20-12+/t11?,13?,14?,15?,16?,17-,19?,21-/m1/s1InChIKey
FTBDZFXCBOAPHD-UNXVEDDCSA-NSynonyms
(1S2Z5R)66dimethyl2(1((1((2R)octahydro1H25methanoinden4yl)ethyl)amino)ethylidene)bicyclo(310)hexan3one
(1S2Z5R)66dimethyl2(1(1(7tricyclo(431038)decanyl)ethylamino)ethylidene)bicyclo(310)hexan3one
(1S5RZ)66dimethyl2(1((1((2S)octahydro1H25methanoinden4yl)ethyl)amino)ethylidene)bicyclo(310)hexan3one
16397962
CC(C1C2CCC3C1CC(C2)C3)NC(=C1C(=O)C(C@@H)2(C@H)1C2(C)C)C
InChI=1SC22H33NOc111(19156514713(815)916(14)19)2312(2)2018(24)101721(20)22(173)4h111317192123H510H214H3b2012+t11?13?14?15?16?1719?21m1s1
ZINC000252693820
ZINC000252693823
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