Vitas-M small molecule compound
(1aR,2S,5aR,6aR,9S,9aR,9bS)-2,5a-dimethyl-9-(thiomorpholinomethyl)octahydro-2H-oxireno[2',3':4,4a]naphtho[2,3-b]furan-8(9bH)-one
Catalog ID
STL527469
SMILES O=C1O[C@H]2[C@@H](C1CN1CCSCC1)[C@@H]1O[C@@]31[C@](C2)(C)CCC[C@@H]3C
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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 C19H29NO3S MW 351.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H29NO3S/c1-12-4-3-5-18(2)10-14-15(16-19(12,18)23-16)13(17(21)22-14)11-20-6-8-24-9-7-20/h12-16H,3-11H2,1-2H3/t12-,13?,14+,15+,16-,18+,19-/m0/s1InChIKey
CKYQAVNWWXHSSL-RWKTXVOJSA-NSynonyms
956932-19-7(1~(R)3~(S)4~(R)8~(R)10~(R)14~(S))1014dimethyl5(thiomorpholin4ylmethyl)27dioxatetracyclo(8400^(13)0^(48))tetradecan6one
(1aR2S5aR6aR9S9aR9bS)25adimethyl9(thiomorpholinomethyl)octahydro2Hoxireno(2344a)naphtho(23b)furan8(9bH)one
16398012
956932197
InChI=1SC19H29NO3Sc11243518(2)101415(1619(1218)2316)13(17(21)2214)112068249720h1216H311H212H3t1213?14+15+1618+19m0s1
MFCD32649861
O=C1O(C@H)2(C@@H)(C1CN1CCSCC1)(C@@H)1O(C@@)31(C@)(C2)(C)CCC(C@@H)3C
ZINC000061996974
ZINC000061996975
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