Vitas-M small molecule compound
(3a'S,8b'R)-2'-(3,4-dimethylphenyl)-3a',6',7',8',8a',8b'-hexahydro-1'H,12H-spiro[indolo[2,1-b]quinazoline-6,4'-pyrrolo[3,4-a]pyrrolizine]-1',3',12(2'H)-trione
Catalog ID
STL569934
SMILES O=C1N(c2ccc(c(c2)C)C)C(=O)[C@H]2[C@@H]1C1CCCN1C12c2ccccc2n2c1nc1ccccc1c2=O
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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 C31H26N4O3 MW 502.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26N4O3/c1-17-13-14-19(16-18(17)2)34-28(37)25-24-12-7-15-33(24)31(26(25)29(34)38)21-9-4-6-11-23(21)35-27(36)20-8-3-5-10-22(20)32-30(31)35/h3-6,8-11,13-14,16,24-26H,7,12,15H2,1-2H3/t24?,25-,26+,31?/m0/s1InChIKey
MHYRXIQJRCPVSR-YWLZOPHJSA-NSynonyms
1177764-89-4(3aS8bR)2(34dimethylphenyl)3a6788a8bhexahydro1H12Hspiro(indolo(21b)quinazoline64pyrrolo(34a)pyrrolizine)1312(2H)trione
(3aS8bR)2(34dimethylphenyl)6788atetrahydro1H12Hspiro(indolo(21b)quinazoline64pyrrolo(34a)pyrrolizine)1312(2H3aH8bH)trione
(3aS8bR)2(34dimethylphenyl)spiro(3a6788a8bhexahydropyrrolo(34a)pyrrolizine46indolo(21b)quinazoline)1312trione
1177764894
17594726
InChI=1SC31H26N4O3c117131419(1618(17)2)3428(37)25241271533(24)31(26(25)29(34)38)219461123(21)3527(36)208351022(20)3230(31)35h368111314162426H71215H212H3t24?2526+31?m0s1
O=C1N(c2ccc(c(c2)C)C)C(=O)(C@H)2(C@@H)1C1CCCN1C12c2ccccc2n2c1nc1ccccc1c2=O
ZINC000013684366
ZINC000253388504
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.