Vitas-M small molecule compound
4-[(3a'S,6a'R)-5-fluoro-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
STK571281
SMILES CC(=O)Oc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cc(F)cc2
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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 C30H23FN4O5 MW 538.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23FN4O5/c1-15(36)40-19-9-7-18(8-10-19)35-27(37)25-24(12-16-14-32-22-5-3-2-4-20(16)22)34-30(26(25)28(35)38)21-13-17(31)6-11-23(21)33-29(30)39/h2-11,13-14,24-26,32,34H,12H2,1H3,(H,33,39)/t24?,25-,26+,30?/m1/s1InChIKey
MYLAWIQSDXQQPT-BBYYJEGRSA-NSynonyms
1014023-26-7(4((3aR6aS)5fluoro1(1Hindol3ylmethyl)246trioxospiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)5yl)phenyl)acetate
1014023267
4((3aS6aR)3((1Hindol3yl)methyl)5fluoro246trioxo3a466atetrahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)5(3H)yl)phenylacetate
4((3aS6aR)5fluoro3(1Hindol3ylmethyl)246trioxo12233a466aoctahydro5Hspiro(indole31pyrrolo(34c)pyrrol)5yl)phenylacetate
CC(=O)OC1=CC=C(C=C1)N2C(=O)C3C(NC4(C3C2=O)C5=C(C=CC(=C5)F)NC4=O)CC6=CNC7=CC=CC=C76
CC(=O)Oc1ccc(cc1)N1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2Cc2c(nH)c3c2cccc3)C(=O)Nc2c1cc(F)cc2
InChI=1SC30H23FN4O5c115(36)40199718(81019)3527(37)2524(1216143222532420(16)22)3430(26(25)28(35)38)211317(31)61123(21)3329(30)39h211131424263234H12H21H3(H3339)t24?2526+30?m1s1
MFCD06775717
ZINC000101110544
ZINC000101110549
Check stock
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