Vitas-M small molecule compound

(2S,7'R)-7-chloro-4,6-dimethoxy-4'-{3-methoxy-4-[(2-methylprop-2-en-1-yl)oxy]phenyl}-7'-methyl-3',4',7',8'-tetrahydro-2'H,3H-spiro[1-benzofuran-2,6'-quinoline]-2',3,5'(1'H)-trione

Catalog ID
STL551230
SMILES COc1cc(ccc1OCC(=C)C)C1CC(=O)NC2=C1C(=O)[C@]1([C@@H](C2)C)Oc2c(C1=O)c(OC)cc(c2Cl)OC

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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 C30H30ClNO8 MW 568.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30ClNO8/c1-14(2)13-39-19-8-7-16(10-20(19)36-4)17-11-23(33)32-18-9-15(3)30(28(34)24(17)18)29(35)25-21(37-5)12-22(38-6)26(31)27(25)40-30/h7-8,10,12,15,17H,1,9,11,13H2,2-6H3,(H,32,33)/t15-,17?,30+/m1/s1
InChIKey
PNJLOFAKHSHOBP-ZRDXRQEBSA-N
Synonyms

(2~(S)7~(R))7chloro46dimethoxy4(3methoxy4(2methylprop2enoxy)phenyl)7methylspiro(1benzofuran263478tetrahydro1~(H)quinoline)235trione
(2S7R)7chloro46dimethoxy4(3methoxy4((2methylallyl)oxy)phenyl)7methyl3478tetrahydro1H3Hspiro(benzofuran26quinoline)235trione
(2S7R)7chloro46dimethoxy4(3methoxy4((2methylprop2en1yl)oxy)phenyl)7methyl3478tetrahydro2H3Hspiro(1benzofuran26quinoline)235(1H)trione
129895048
COc1cc(ccc1OCC(=C)C)C1CC(=O)NC2=C1C(=O)(C@)1((C@@H)(C2)C)Oc2c(C1=O)c(OC)cc(c2Cl)OC
InChI=1SC30H30ClNO8c114(2)1339198716(1020(19)364)171123(33)3218915(3)30(28(34)24(17)18)29(35)2521(375)1222(386)26(31)27(25)4030h7810121517H191113H226H3(H3233)t1517?30+m1s1
ZINC000524729965
ZINC000524729966

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Available files

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