Vitas-M small molecule compound
(2S,7'R)-7-chloro-4,6-dimethoxy-4'-(4-methoxynaphthalen-1-yl)-7'-methyl-3',4',7',8'-tetrahydro-2'H,3H-spiro[1-benzofuran-2,6'-quinoline]-2',3,5'(1'H)-trione
Catalog ID
STL551225
SMILES COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)CC2=C(C1=O)C(CC(=O)N2)c1ccc(c2c1cccc2)OC)Cl
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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 C30H26ClNO7 MW 547.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26ClNO7/c1-14-11-19-24(18(12-23(33)32-19)16-9-10-20(36-2)17-8-6-5-7-15(16)17)28(34)30(14)29(35)25-21(37-3)13-22(38-4)26(31)27(25)39-30/h5-10,13-14,18H,11-12H2,1-4H3,(H,32,33)/t14-,18?,30+/m1/s1InChIKey
CWQCZGNUARLXDV-JMPJBRGLSA-NSynonyms
(2~(S)7~(R))7chloro46dimethoxy4(4methoxynaphthalen1yl)7methylspiro(1benzofuran263478tetrahydro1~(H)quinoline)235trione
(2S7R)7chloro46dimethoxy4(4methoxynaphthalen1yl)7methyl3478tetrahydro1H3Hspiro(benzofuran26quinoline)235trione
(2S7R)7chloro46dimethoxy4(4methoxynaphthalen1yl)7methyl3478tetrahydro2H3Hspiro(1benzofuran26quinoline)235(1H)trione
129895807
COc1cc(OC)c(c2c1C(=O)(C@)1(O2)(C@H)(C)CC2=C(C1=O)C(CC(=O)N2)c1ccc(c2c1cccc2)OC)Cl
InChI=1SC30H26ClNO7c114111924(18(1223(33)3219)1691020(362)17865715(16)17)28(34)30(14)29(35)2521(373)1322(384)26(31)27(25)3930h510131418H1112H214H3(H3233)t1418?30+m1s1
ZINC000524731588
ZINC000524731589
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