Vitas-M small molecule compound
(5S,6S,11aR,11bS)-5-{[2-(1H-indol-3-yl)ethyl]amino}-5,6,9,10,11,11a-hexahydro-8H-6,11b-methanofuro[2,3-c]pyrido[1,2-a]azepin-2(3H)-one
Catalog ID
STL565494
SMILES O=C1CC2=C[C@@H](C3C[C@@]2(O1)[C@H]1CCCCN31)NCCc1c[nH]c2c1cccc2
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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 C23H27N3O2 MW 377.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O2/c27-22-12-16-11-19(20-13-23(16,28-22)21-7-3-4-10-26(20)21)24-9-8-15-14-25-18-6-2-1-5-17(15)18/h1-2,5-6,11,14,19-21,24-25H,3-4,7-10,12-13H2/t19-,20-,21+,23-/m0/s1InChIKey
DACSTSLWMITFKA-QXUYBEEESA-NSynonyms
1212427-47-8(1S2R8S9S)9(2(1Hindol3yl)ethylamino)14oxa7azatetracyclo(6610111027)pentadec10en13one
(5S6S11aR11bS)5((2(1Hindol3yl)ethyl)amino)35689101111aoctahydro2H611bmethanofuro(23c)pyrido(12a)azepin2one
(5S6S11aR11bS)5((2(1Hindol3yl)ethyl)amino)569101111ahexahydro8H611bmethanofuro(23c)pyrido(12a)azepin2(3H)one
11876693
1212427478
InChI=1SC23H27N3O2c272212161119(201323(162822)217341026(20)21)249815142518621517(15)18h1256111419212425H347101213H2t192021+23m0s1
MFCD32651688
O=C1CC2=C(C@@H)((C@@H)3C(C@@)2(O1)(C@H)1CCCCN31)NCCc1c(nH)c2c1cccc2
ZINC000020612207
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