Vitas-M small molecule compound
(1aR,4aR,5aR,8S,8aR,9aS)-1a,4a-dimethyl-8-((4-(pyridin-2-yl)piperazin-1-yl)methyl)octahydro-1aH-oxireno[2',3':4a,5]naphtho[2,3-b]furan-7(8H)-one
Catalog ID
STL540219
SMILES O=C1O[C@H]2[C@@H](C1CN1CCN(CC1)c1ccccn1)C[C@@]13[C@](C2)(C)CCC[C@]3(O1)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 C24H33N3O3 MW 411.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H33N3O3/c1-22-7-5-8-23(2)24(22,30-23)14-17-18(21(28)29-19(17)15-22)16-26-10-12-27(13-11-26)20-6-3-4-9-25-20/h3-4,6,9,17-19H,5,7-8,10-16H2,1-2H3/t17-,18?,19-,22-,23-,24+/m1/s1InChIKey
OYYYZYOJEOADLX-PDPHTBTASA-NSynonyms
956974-93-9(1~(S)3~(R)7~(R)9~(R)13~(R))913dimethyl4((4pyridin2ylpiperazin1yl)methyl)614dioxatetracyclo(7500^(113)0^(37))tetradecan5one
(1aR4aR5aR8S8aR9aS)1a4adimethyl8((4(pyridin2yl)piperazin1yl)methyl)octahydro1aHoxireno(234a5)naphtho(23b)furan7(8H)one
16401435
956974939
InChI=1SC24H33N3O3c12275823(2)24(223023)141718(21(28)2919(17)1522)1626101227(131126)2063492520h34691719H5781016H212H3t1718?19222324+m1s1
MFCD32650003
O=C1O(C@H)2(C@@H)(C1CN1CCN(CC1)c1ccccn1)C(C@@)13(C@)(C2)(C)CCC(C@)3(O1)C
ZINC000004081213
ZINC000012869615
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