Vitas-M small molecule compound

1-[(2'S,3a'R,7a'S)-hexahydrospiro[cycloheptane-1,5'-[1,8]dioxa[6]aza[2,7a]epoxyoxireno[h]isoquinolin]-6'(7'H)-yl]ethanone

Catalog ID
STL552933
SMILES CC(=O)N1C[C@@]23O[C@H](C[C@H]2CC21CCCCCC2)C1C3O1

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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 C17H25NO3 MW 291.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H25NO3/c1-11(19)18-10-17-12(8-13(21-17)14-15(17)20-14)9-16(18)6-4-2-3-5-7-16/h12-15H,2-10H2,1H3/t12-,13-,14?,15?,17+/m0/s1
InChIKey
HBSVSXMSHFCYOY-HYRMGMASSA-N
Synonyms
1212458-16-6
1((1~(S)6~(R)8~(S))spiro(1012dioxa3azatetracyclo(6310^(16)0^(911))dodecane41cycloheptane)3yl)ethanone
1((2S3aR7aS)hexahydrospiro(cycloheptane15(18)dioxa(6)aza(27a)epoxyoxireno(h)isoquinolin)6(7H)yl)ethanone
1((2S3aR7aS)tetrahydrospiro(27aepoxyoxireno(23h)isoquinoline51cycloheptan)6(1aH7H7bH)yl)ethanone
1212458166
16397271
CC(=O)N1C(C@@)23O(C@@H)(C(C@H)2CC21CCCCCC2)C1C3O1
InChI=1SC17H25NO3c111(19)18101712(813(2117)1415(17)2014)916(18)64235716h1215H210H21H3t121314?15?17+m0s1
ZINC000004028973
ZINC000100745652

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Available files

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