Vitas-M small molecule compound

(6aS,6bR,9aS,10R)-8-(4-methylphenyl)-7,9-dioxo-10-(phenylcarbonyl)-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinolin-1-yl acetate

Catalog ID
STK558603
SMILES Cc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1c(ccc2)OC(=O)C)C(=O)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 C30H24N2O5 MW 492.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24N2O5/c1-17-11-14-21(15-12-17)31-29(35)24-22-16-13-19-9-6-10-23(37-18(2)33)26(19)32(22)27(25(24)30(31)36)28(34)20-7-4-3-5-8-20/h3-16,22,24-25,27H,1-2H3/t22-,24-,25-,27+/m0/s1
InChIKey
ABRSXJXOKZLPEM-WVAUJHLCSA-N
Synonyms
1013747-50-6
(6aS6bR9aS10R)10benzoyl79dioxo8(ptolyl)6b7899a10hexahydro6aHpyrrolo(3434)pyrrolo(12a)quinolin1ylacetate
(6aS6bR9aS10R)8(4methylphenyl)79dioxo10(phenylcarbonyl)6b7899a10hexahydro6aHpyrrolo(3434)pyrrolo(12a)quinolin1ylacetate
1013747506
CC1=CC=C(C=C1)N2C(=O)C3C4C=CC5=C(N4C(C3C2=O)C(=O)C6=CC=CC=C6)C(=CC=C5)OC(=O)C
Cc1ccc(cc1)N1C(=O)(C@@H)2(C@H)(C1=O)(C@@H)(N1(C@H)2C=Cc2c1c(ccc2)OC(=O)C)C(=O)c1ccccc1
InChI=1SC30H24N2O5c117111421(151217)3129(35)2422161319961023(3718(2)33)26(19)32(22)27(25(24)30(31)36)28(34)207435820h31622242527H12H3t22242527+m0s1
MFCD18243099
ZINC000101088896
ZINC101088896

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Available files

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