Vitas-M small molecule compound

butyl (3S)-2'-amino-1-(2-methoxy-2-oxoethyl)-2,5'-dioxo-1,2-dihydro-5'H-spiro[indole-3,4'-pyrano[3,2-c]chromene]-3'-carboxylate

Catalog ID
STL006042
SMILES CCCCOC(=O)C1=C(N)Oc2c([C@]31c1ccccc1N(C3=O)CC(=O)OC)c(=O)oc1c2cccc1

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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 C27H24N2O8 MW 504.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24N2O8/c1-3-4-13-35-24(31)21-23(28)37-22-15-9-5-8-12-18(15)36-25(32)20(22)27(21)16-10-6-7-11-17(16)29(26(27)33)14-19(30)34-2/h5-12H,3-4,13-14,28H2,1-2H3/t27-/m0/s1
InChIKey
WCNSDFYYPNPUIS-MHZLTWQESA-N
Synonyms
1212218-75-1
(S)butyl2amino1(2methoxy2oxoethyl)25dioxo5Hspiro(indoline34pyrano(32c)chromene)3carboxylate
1212218751
butyl(3S)2amino1(2methoxy2oxoethyl)25dioxo12dihydro5Hspiro(indole34pyrano(32c)chromene)3carboxylate
BUTYL(3S)2AMINO1(2METHOXY2OXOETHYL)25DIOXOSPIRO(INDOLE34PYRANO(32C)CHROMENE)3CARBOXYLATE
CCCCOC(=O)C1=C(N)Oc2c((C@)31c1ccccc1N(C3=O)CC(=O)OC)c(=O)oc1c2cccc1
CCCCOC(=O)C1=C(OC2=C(C13C4=CC=CC=C4N(C3=O)CC(=O)OC)C(=O)OC5=CC=CC=C52)N
InChI=1SC27H24N2O8c134133524(31)2123(28)3722159581218(15)3625(32)20(22)27(21)1610671117(16)29(26(27)33)1419(30)342h512H34131428H212H3t27m0s1
MFCD24857506
ZINC000009291637
ZINC09291637
ZINC9291637

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Available files

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