Vitas-M small molecule compound

(8R,8aS,11aR)-10-(2,4-dimethylphenyl)-8-(2,2-dimethylpropanoyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione

Catalog ID
STK557768
SMILES Cc1ccc(c(c1)C)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1C2c2ccccc2C=C1)C(=O)C(C)(C)C

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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 C27H28N2O3 MW 428.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O3/c1-15-10-11-19(16(2)14-15)29-25(31)20-21(26(29)32)23(24(30)27(3,4)5)28-13-12-17-8-6-7-9-18(17)22(20)28/h6-14,20-23H,1-5H3/t20-,21+,22?,23-/m1/s1
InChIKey
NOGABQKHFOYBGO-HNTVYWHESA-N
Synonyms
1013793-38-8
(8R8aS11aR)10(24dimethylphenyl)8(22dimethylpropanoyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
(8R8aS11aR)10(24dimethylphenyl)8pivaloyl11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
1013793388
CC1=CC(=C(C=C1)N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=C4)C(=O)C(C)(C)C)C
Cc1ccc(c(c1)C)N1C(=O)(C@@H)2(C@H)(C1=O)(C@@H)(N1C2c2ccccc2C=C1)C(=O)C(C)(C)C
InChI=1SC27H28N2O3c115101119(16(2)1415)2925(31)2021(26(29)32)23(24(30)27(34)5)28131217867918(17)22(20)28h6142023H15H3t2021+22?23m1s1
MFCD18243031
ZINC000043726430
ZINC000043726431

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.