Vitas-M small molecule compound
(6'S,8a'R)-4',4a',5',6'-tetrahydrospiro[cycloheptane-1,3'-[9]oxa[2]aza[6,8a]epoxyisoquinoline]-2'(1'H)-carbaldehyde
Catalog ID
STL553096
SMILES O=CN1C[C@@]23C=C[C@H](O2)CC3CC21CCCCCC2
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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 C16H23NO2 MW 261.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23NO2/c18-12-17-11-16-8-5-14(19-16)9-13(16)10-15(17)6-3-1-2-4-7-15/h5,8,12-14H,1-4,6-7,9-11H2/t13?,14-,16-/m1/s1InChIKey
WACYCSFGKQIXLB-IGLHTZBQSA-NSynonyms
1212479-03-2(1~(R)8~(S))spiro(11oxa3azatricyclo(6210^(16))undec9ene41cycloheptane)3carbaldehyde
(6S8aR)44a56tetrahydrospiro(68aepoxyisoquinoline31cycloheptane)2(1H)carbaldehyde
(6S8aR)44a56tetrahydrospiro(cycloheptane13(9)oxa(2)aza(68a)epoxyisoquinoline)2(1H)carbaldehyde
1212479032
16398083
InChI=1SC16H23NO2c18121711168514(1916)913(16)1015(17)63124715h581214H1467911H2t13?1416m1s1
O=CN1C(C@@)23C=C(C@@H)(O2)CC3CC21CCCCCC2
ZINC000004041898
ZINC000004041903
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