Vitas-M small molecule compound
methyl (1S,4aR,5S)-1,4a-dimethyl-6-methylidene-5-{2-[2-(piperidin-1-ylmethyl)furan-3-yl]ethyl}decahydronaphthalene-1-carboxylate
Catalog ID
STL562437
SMILES COC(=O)[C@@]1(C)CCC[C@]2(C1CCC(=C)[C@@H]2CCc1ccoc1CN1CCCCC1)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 C27H41NO3 MW 427.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H41NO3/c1-20-9-12-24-26(2,14-8-15-27(24,3)25(29)30-4)22(20)11-10-21-13-18-31-23(21)19-28-16-6-5-7-17-28/h13,18,22,24H,1,5-12,14-17,19H2,2-4H3/t22-,24?,26+,27-/m0/s1InChIKey
FSLAVQGJZYEXIY-CJGRIHGTSA-NSynonyms
1214632-84-4(1S4aR5S)methyl14adimethyl6methylene5(2(2(piperidin1ylmethyl)furan3yl)ethyl)decahydronaphthalene1carboxylate
1214632844
16397263
COC(=O)(C@@)1(C)CCC(C@)2(C1CCC(=C)(C@@H)2CCc1ccoc1CN1CCCCC1)C
InChI=1SC27H41NO3c1209122426(21481527(243)25(29)304)22(20)11102113183123(21)1928166571728h13182224H1512141719H224H3t2224?26+27m0s1
methyl(1S4aR5S)14adimethyl6methylidene5(2(2(piperidin1ylmethyl)furan3yl)ethyl)345788ahexahydro2Hnaphthalene1carboxylate
methyl(1S4aR5S)14adimethyl6methylidene5(2(2(piperidin1ylmethyl)furan3yl)ethyl)decahydronaphthalene1carboxylate
MFCD32651259
ZINC000004028949
ZINC000004028950
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