Vitas-M small molecule compound
5'-(2,4-dimethoxyphenyl)-5',6'-dihydrospiro[cyclooctane-1,2'-pyrano[4,3-a][4,7]phenanthrolin]-4'(1'H)-one
Catalog ID
STK770784
SMILES COc1cc(OC)ccc1C1Nc2ccc3c(c2C2=C1C(=O)OC1(C2)CCCCCCC1)cccn3
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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 C30H32N2O4 MW 484.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N2O4/c1-34-19-10-11-21(25(17-19)35-2)28-27-22(18-30(36-29(27)33)14-6-4-3-5-7-15-30)26-20-9-8-16-31-23(20)12-13-24(26)32-28/h8-13,16-17,28,32H,3-7,14-15,18H2,1-2H3InChIKey
DAQWXHBPCMSDGW-UHFFFAOYSA-NSynonyms
5(24dimethoxyphenyl)56dihydrospiro(cyclooctane12pyrano(43a)(47)phenanthrolin)4(1H)one
5(24DIMETHOXYPHENYL)SPIRO(56DIHYDRO1HPYRANO(43A)(47)PHENANTHROLINE21CYCLOOCTANE)4ONE
COC1=CC(=C(C=C1)C2C3=C(CC4(CCCCCCC4)OC3=O)C5=C(N2)C=CC6=C5C=CC=N6)OC
InChI=1SC30H32N2O4c13419101121(25(1719)352)282722(1830(3629(27)33)14643571530)262098163123(20)121324(26)3228h81316172832H37141518H212H3
MFCD03766614
ZINC000002192805
ZINC000008846748
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