Vitas-M small molecule compound
(1aR,2S,5aR,6aR,9S,9aR,9bS)-9-(((2,2-dimethoxyethyl)(methyl)amino)methyl)-2,5a-dimethyloctahydro-2H-oxireno[2',3':4,4a]naphtho[2,3-b]furan-8(9bH)-one
Catalog ID
STL562444
SMILES COC(CN(CC1C(=O)O[C@H]2[C@@H]1[C@@H]1O[C@@]31[C@](C2)(C)CCC[C@@H]3C)C)OC
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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 C20H33NO5 MW 367.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H33NO5/c1-12-7-6-8-19(2)9-14-16(17-20(12,19)26-17)13(18(22)25-14)10-21(3)11-15(23-4)24-5/h12-17H,6-11H2,1-5H3/t12-,13?,14+,16+,17-,19+,20-/m0/s1InChIKey
VDNOZODENXPGDB-XMQHIZTBSA-NSynonyms
1212446-13-3(1aR2S5aR6aR9S9aR9bS)9(((22dimethoxyethyl)(methyl)amino)methyl)25adimethyloctahydro2Hoxireno(2344a)naphtho(23b)furan8(9bH)one
(1R3S4R8R10R14S)5((22dimethoxyethyl(methyl)amino)methyl)1014dimethyl27dioxatetracyclo(840013048)tetradecan6one
1212446133
16397010
COC(CN(CC1C(=O)O(C@H)2(C@@H)1(C@@H)1O(C@@)31(C@)(C2)(C)CCC(C@@H)3C)C)OC
InChI=1SC20H33NO5c11276819(2)91416(1720(1219)2617)13(18(22)2514)1021(3)1115(234)245h1217H611H215H3t1213?14+16+1719+20m0s1
MFCD32651262
ZINC000061992824
ZINC000061992825
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