Vitas-M small molecule compound

(8S,8aR,11aS,11bS)-10-(2-methoxyphenyl)-8-(phenylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione

Catalog ID
STK555550
SMILES COc1ccccc1N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)c2ccccc2)C=Cc2c1cccc2

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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 C28H22N2O4 MW 450.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N2O4/c1-34-21-14-8-7-13-20(21)30-27(32)22-23(28(30)33)25(26(31)18-10-3-2-4-11-18)29-16-15-17-9-5-6-12-19(17)24(22)29/h2-16,22-25H,1H3/t22-,23+,24+,25-/m0/s1
InChIKey
HOCNPLYQPYCNMJ-LIONHTAISA-N
Synonyms
1013987-27-3
(8S8aR11aS11bS)10(2methoxyphenyl)8(phenylcarbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
(8S8aR11aS11bS)8benzoyl10(2methoxyphenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
1013987273
COC1=CC=CC=C1N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=C4)C(=O)C6=CC=CC=C6
COc1ccccc1N1C(=O)(C@@H)2(C@H)(C1=O)(C@@H)1N((C@@H)2C(=O)c2ccccc2)C=Cc2c1cccc2
InChI=1SC28H22N2O4c1342114871320(21)3027(32)2223(28(30)33)25(26(31)18103241118)291615179561219(17)24(22)29h2162225H1H3t2223+24+25m0s1
MFCD18242872
ZINC000015974731
ZINC15974731

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Available files

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