Vitas-M small molecule compound
4-[(3S,3a'R,8b'S)-1',2,3'-trioxo-1,1',2,3',3a',6',7',8',8a',8b'-decahydro-2'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizin]-2'-yl]phenyl acetate
Catalog ID
STK631140
SMILES CC(=O)Oc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3C2CCC3)C(=O)Nc2c1cccc2
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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 C24H21N3O5 MW 431.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3O5/c1-13(28)32-15-10-8-14(9-11-15)27-21(29)19-18-7-4-12-26(18)24(20(19)22(27)30)16-5-2-3-6-17(16)25-23(24)31/h2-3,5-6,8-11,18-20H,4,7,12H2,1H3,(H,25,31)/t18?,19-,20+,24-/m1/s1InChIKey
RDYYNNNAKVQNDY-JLVXQPSGSA-NSynonyms
1013885-19-2(4((3S3aR8bS)123trioxospiro(1Hindole343a6788a8bhexahydropyrrolo(34a)pyrrolizine)2yl)phenyl)acetate
1013885192
4((3S3aR8bS)123trioxo11233a6788a8bdecahydro2Hspiro(indole34pyrrolo(34a)pyrrolizin)2yl)phenylacetate
4((3S3aR8bS)123trioxo33a6788ahexahydro1Hspiro(indoline34pyrrolo(34a)pyrrolizine)2(8bH)yl)phenylacetate
CC(=O)OC1=CC=C(C=C1)N2C(=O)C3C4CCCN4C5(C3C2=O)C6=CC=CC=C6NC5=O
CC(=O)Oc1ccc(cc1)N1C(=O)(C@H)2(C@@H)(C1=O)(C@@)1(N3C2CCC3)C(=O)Nc2c1cccc2
InChI=1SC24H21N3O5c113(28)321510814(91115)2721(29)1918741226(18)24(20(19)22(27)30)16523617(16)2523(24)31h23568111820H4712H21H3(H2531)t18?1920+24m1s1
MFCD18246533
ZINC000020504075
ZINC000020504076
Check stock
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Check stock on Vitas-MAvailable files
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