Vitas-M small molecule compound
4-[(3a'S,6a'R)-3'-(1H-indol-3-ylmethyl)-2,4',6'-trioxo-1,2,2',3',3a',4',6',6a'-octahydro-5'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-5'-yl]phenyl acetate
Catalog ID
STL532597
SMILES CC(=O)Oc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)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 C30H24N4O5 MW 520.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24N4O5/c1-16(35)39-19-12-10-18(11-13-19)34-27(36)25-24(14-17-15-31-22-8-4-2-6-20(17)22)33-30(26(25)28(34)37)21-7-3-5-9-23(21)32-29(30)38/h2-13,15,24-26,31,33H,14H2,1H3,(H,32,38)/t24?,25-,26+,30?/m1/s1InChIKey
IMVGSRICQLARGJ-BBYYJEGRSA-NSynonyms
956998-34-8(4((3~(a)~(R)6~(a)~(S))1(1~(H)indol3ylmethyl)246trioxospiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)5yl)phenyl)acetate
16406448
4((3aS6aR)3((1Hindol3yl)methyl)246trioxo3a466atetrahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)5(3H)yl)phenylacetate
4((3aS6aR)3(1Hindol3ylmethyl)246trioxo12233a466aoctahydro5Hspiro(indole31pyrrolo(34c)pyrrol)5yl)phenylacetate
956998348
CC(=O)Oc1ccc(cc1)N1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2Cc2c(nH)c3c2cccc3)C(=O)Nc2c1cccc2
InChI=1SC30H24N4O5c116(35)3919121018(111319)3427(36)2524(1417153122842620(17)22)3330(26(25)28(34)37)21735923(21)3229(30)38h2131524263133H14H21H3(H3238)t24?2526+30?m1s1
MFCD07637728
ZINC000016026477
ZINC000035877453
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.