Vitas-M small molecule compound
3,3-dimethyl-14-phenyl-2,3,4,6,7,14-hexahydro-1H-[1,3]dioxolo[6,7]isoquino[2,1-a]quinolin-1-one
Catalog ID
STL530589
SMILES O=C1CC(C)(C)CC2=C1C(C=C1N2CCc2c1cc1OCOc1c2)c1ccccc1
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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 C26H25NO3 MW 399.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25NO3/c1-26(2)13-21-25(22(28)14-26)19(16-6-4-3-5-7-16)11-20-18-12-24-23(29-15-30-24)10-17(18)8-9-27(20)21/h3-7,10-12,19H,8-9,13-15H2,1-2H3InChIKey
NEHMNOGSUBWBSJ-UHFFFAOYSA-NSynonyms
879773-10-11616dimethyl20phenyl57dioxa13azapentacyclo(11800^(210)0^(48)0^(1419))henicosa1(21)24(8)914(19)pentaen18one
16405519
33dimethyl14phenyl2346714hexahydro1H(13)dioxolo(4567)isoquinolino(21a)quinolin1one
33dimethyl14phenyl2346714hexahydro1H(13)dioxolo(67)isoquino(21a)quinolin1one
879773101
InChI=1SC26H25NO3c126(2)132125(22(28)1426)19(166435716)112018122423(29153024)1017(18)8927(20)21h37101219H891315H212H3
MFCD07637020
ZINC000004090193
ZINC000004090195
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