Vitas-M small molecule compound
2-amino-6',7,7-trimethyl-2',5-dioxo-5,5',6,6',7,8-hexahydrodispiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline-4',1''-cyclohexane]-3-carbonitrile
Catalog ID
STL355088
SMILES N#CC1=C(N)OC2=C(C31c1cccc4c1N(C3=O)C1(CCCCC1)CC4C)C(=O)CC(C2)(C)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 C28H31N3O3 MW 457.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O3/c1-16-12-27(10-5-4-6-11-27)31-23-17(16)8-7-9-18(23)28(25(31)33)19(15-29)24(30)34-21-14-26(2,3)13-20(32)22(21)28/h7-9,16H,4-6,10-14,30H2,1-3H3InChIKey
RLIDMCYUAMGURR-UHFFFAOYSA-NSynonyms
2amino677trimethyl25dioxo556678hexahydrodispiro(chromene41pyrrolo(321ij)quinoline41cyclohexane)3carbonitrile
CC1CC2(CCCCC2)N3C4=C1C=CC=C4C5(C3=O)C(=C(OC6=C5C(=O)CC(C6)(C)C)N)C#N
InChI=1SC28H31N3O3c1161227(105461127)312317(16)87918(23)28(25(31)33)19(1529)24(30)34211426(23)1320(32)22(21)28h7916H46101430H213H3
MFCD06755277
ZINC000022564431
ZINC000022564444
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