Vitas-M small molecule compound
(3S,3aR,5S,8aR,9aR)-3-((didecylamino)methyl)-5,8a-dimethyl-3,3a,6,7,8,8a,9,9a-octahydronaphtho[2,3-b]furan-2(5H)-one
Catalog ID
STL562280
SMILES CCCCCCCCCCN(CC1C(=O)O[C@H]2[C@@H]1C=C1[C@@H](C)CCC[C@@]1(C2)C)CCCCCCCCCC
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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 C35H63NO2 MW 529.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H63NO2/c1-5-7-9-11-13-15-17-19-24-36(25-20-18-16-14-12-10-8-6-2)28-31-30-26-32-29(3)22-21-23-35(32,4)27-33(30)38-34(31)37/h26,29-31,33H,5-25,27-28H2,1-4H3/t29-,30+,31?,33+,35+/m0/s1InChIKey
CQZMSZOZLNFCKS-FZOANZNNSA-NSynonyms
312963-44-3(3aR5S8aR9aR)3((didecylamino)methyl)58adimethyl33a567899aoctahydrobenzo(f)(1)benzofuran2one
(3S3aR5S8aR9aR)3((didecylamino)methyl)58adimethyl33a6788a99aoctahydronaphtho(23b)furan2(5H)one
16395111
312963443
CCCCCCCCCCN(CC1C(=O)O(C@H)2(C@@H)1C=C1(C@@H)(C)CCC(C@@)1(C2)C)CCCCCCCCCC
InChI=1SC35H63NO2c157911131517192436(25201816141210862)283130263229(3)22212335(324)2733(30)3834(31)37h26293133H5252728H214H3t2930+31?33+35+m0s1
MFCD32651215
ZINC000070664600
ZINC000070664602
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