Vitas-M small molecule compound
(6-{6-[bis(phenylcarbonyl)amino]-9H-purin-9-yl}-2,2-dioxidotetrahydrofuro[3,4-d][1,3,2]dioxathiol-4-yl)methyl benzoate
Catalog ID
STL565368
SMILES O=C(c1ccccc1)OCC1OC(C2C1OS(=O)(=O)O2)n1cnc2c1ncnc2N(C(=O)c1ccccc1)C(=O)c1ccccc1
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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 C31H23N5O9S MW 641.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H23N5O9S/c37-28(19-10-4-1-5-11-19)36(29(38)20-12-6-2-7-13-20)27-23-26(32-17-33-27)35(18-34-23)30-25-24(44-46(40,41)45-25)22(43-30)16-42-31(39)21-14-8-3-9-15-21/h1-15,17-18,22,24-25,30H,16H2InChIKey
SJZLATJRXACVKA-UHFFFAOYSA-NSynonyms
((3aR4R6R6aR)6(6(Nbenzoylbenzamido)9Hpurin9yl)22dioxidotetrahydrofuro(34d)(132)dioxathiol4yl)methylbenzoate
(4(6(dibenzoylamino)purin9yl)22dioxo3a466atetrahydrofuro(34d)(132)dioxathiol6yl)methylbenzoate
(6(6(bis(phenylcarbonyl)amino)9Hpurin9yl)22dioxidotetrahydrofuro(34d)(132)dioxathiol4yl)methylbenzoate
3833496
InChI=1SC31H23N5O9Sc3728(19104151119)36(29(38)20126271320)272326(32173327)35(183423)302524(4446(4041)4525)22(4330)164231(39)21148391521h115171822242530H16H2
MFCD00546455
O=C(c1ccccc1)OC(C@H)1O(C@H)((C@H)2(C@@H)1OS(=O)(=O)O2)n1cnc2c1ncnc2N(C(=O)c1ccccc1)C(=O)c1ccccc1
ZINC000085867078
ZINC000247425691
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