Vitas-M small molecule compound
8-(benzylamino)-7-hexadecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK528686
SMILES CCCCCCCCCCCCCCCCn1c(NCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C
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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 C29H45N5O2 MW 495.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H45N5O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-34-25-26(33(2)29(36)32-27(25)35)31-28(34)30-23-24-20-17-16-18-21-24/h16-18,20-21H,3-15,19,22-23H2,1-2H3,(H,30,31)(H,32,35,36)InChIKey
NIOYFLNVRZBYAV-UHFFFAOYSA-NSynonyms
370871-93-5370871935
8(benzylamino)7hexadecyl3methyl1Hpurine26(3H7H)dione
8(benzylamino)7hexadecyl3methyl37dihydro1Hpurine26dione
8(BENZYLAMINO)7HEXADECYL3METHYLPURINE26DIONE
CCCCCCCCCCCCCCCCn1c(NCc2ccccc2)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCCCCCCCCCCCN1C2=C(N=C1NCC3=CC=CC=C3)N(C(=O)NC2=O)C
InChI=1SC29H45N5O2c134567891011121314151922342526(33(2)29(36)3227(25)35)3128(34)302324201716182124h16182021H315192223H212H3(H3031)(H323536)
MFCD01079466
ZINC000100667827
ZINC100667827
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