Vitas-M small molecule compound
1-((1aR,1bR,4R,4aS,7R,7aS,9aR)-7,9a-dimethyl-3-oxodecahydro-1aH-oxireno[2',3':7,8]naphtho[8a,1-b]furan-4-yl)-N,N,N-trimethylmethanaminium iodide
Catalog ID
STL553207
SMILES O=C1O[C@@]23[C@H](C1C[N+](C)(C)C)CC[C@H]([C@@H]2CC[C@@]1([C@H]3O1)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 C18H30NO3 MW 308.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H30NO3/c1-11-6-7-14-12(10-19(3,4)5)15(20)21-18(14)13(11)8-9-17(2)16(18)22-17/h11-14,16H,6-10H2,1-5H3/q+1/t11-,12?,13+,14+,16-,17-,18-/m1/s1InChIKey
SNGWWISTWVXYJT-BGAMWSFZSA-NSynonyms
((1~(R)5~(S)8~(R)9~(S)12~(R)14~(R))812dimethyl3oxo213dioxatetracyclo(7500^(15)0^(1214))tetradecan4yl)methyltrimethylazanium
1((1aR1bR4R4aS7R7aS9aR)79adimethyl3oxodecahydro1aHoxireno(2378)naphtho(8a1b)furan4yl)NNNtrimethylmethanaminiumiodide
16400711
InChI=1SC18H30NO3c111671412(1019(34)5)15(20)2118(14)13(11)8917(2)16(18)2217h111416H610H215H3q+1t1112?13+14+161718m1s1
O=C1O(C@@)23(C@H)(C1C(N+)(C)(C)C)CC(C@H)((C@@H)2CC(C@@)1((C@H)3O1)C)C(I)
ZINC000004073605
ZINC000012865831
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