Vitas-M small molecule compound

(3S,3aR,8aR,9aR)-3-(((2,2-dimethoxyethyl)(methyl)amino)methyl)-8a-methyl-5-methylenedecahydronaphtho[2,3-b]furan-2(3H)-one

Catalog ID
STL562719
SMILES COC(CN(CC1C(=O)O[C@H]2[C@@H]1CC1C(=C)CCC[C@@]1(C2)C)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 C20H33NO4 MW 351.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H33NO4/c1-13-7-6-8-20(2)10-17-14(9-16(13)20)15(19(22)25-17)11-21(3)12-18(23-4)24-5/h14-18H,1,6-12H2,2-5H3/t14-,15?,16?,17-,20-/m1/s1
InChIKey
YHZOBPBMQMCRTE-BPTCHOHDSA-N
Synonyms
956157-82-7
(3aR8aR9aR)3((22dimethoxyethyl(methyl)amino)methyl)8amethyl5methylidene3a44a67899aoctahydro3Hbenzo(f)(1)benzofuran2one
(3S3aR8aR9aR)3(((22dimethoxyethyl)(methyl)amino)methyl)8amethyl5methylenedecahydronaphtho(23b)furan2(3H)one
16398248
956157827
COC(CN(CC1C(=O)O(C@H)2(C@@H)1CC1C(=C)CCC(C@@)1(C2)C)C)OC
InChI=1SC20H33NO4c11376820(2)101714(916(13)20)15(19(22)2517)1121(3)1218(234)245h1418H1612H225H3t1415?16?1720m1s1
ZINC000035361866
ZINC000061695589

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Available files

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