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4-[(3a'R,6a'S)-3'-(2-methylpropyl)-4',6',12-trioxo-2',3',3a',4',6',6a'-hexahydro-5'H,12H-spiro[indolo[2,1-b]quinazoline-6,1'-pyrrolo[3,4-c]pyrrol]-5'-yl]benzoic acid

Catalog ID
STL565985
SMILES CC(CC1NC2([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc(cc1)C(=O)O)c1ccccc1n1c2nc2ccccc2c1=O)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 C31H26N4O5 MW 534.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26N4O5/c1-16(2)15-22-24-25(28(38)34(27(24)37)18-13-11-17(12-14-18)29(39)40)31(33-22)20-8-4-6-10-23(20)35-26(36)19-7-3-5-9-21(19)32-30(31)35/h3-14,16,22,24-25,33H,15H2,1-2H3,(H,39,40)/t22?,24-,25+,31?/m0/s1
InChIKey
FOVYMHIGTUUOLV-CGFQQYPISA-N
Synonyms
1177921-33-3
1177921333
17572225
4((3aR6aS)3(2methylpropyl)4612trioxo233a466ahexahydro5H12Hspiro(indolo(21b)quinazoline61pyrrolo(34c)pyrrol)5yl)benzoicacid
4((3aR6aS)3isobutyl4612trioxo3a466atetrahydro2H12Hspiro(indolo(21b)quinazoline61pyrrolo(34c)pyrrol)5(3H)yl)benzoicacid
4((3aS6aR)1(2methylpropyl)4612trioxospiro(123a6atetrahydropyrrolo(34c)pyrrole36indolo(21b)quinazoline)5yl)benzoicacid
CC(CC1NC2((C@@H)3(C@H)1C(=O)N(C3=O)c1ccc(cc1)C(=O)O)c1ccccc1n1c2nc2ccccc2c1=O)C
InChI=1SC31H26N4O5c116(2)15222425(28(38)34(27(24)37)18131117(121418)29(39)40)31(3322)208461023(20)3526(36)19735921(19)3230(31)35h3141622242533H15H212H3(H3940)t22?2425+31?m0s1
ZINC000070712278
ZINC000070712284

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Available files

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