Basic Information |
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Product Name: | 1-(5-HYDROXY-5-METHYLHEXYL)-3-METHYLXANTHINE |
CAS: | 107767-55-5 |
English Synonyms: | 1-(5-HYDROXY-5-METHYLHEXYL)-3-METHYLXANTHINE ; ALBIFYLLINE |
MDL Number.: | MFCD00884660 |
H bond acceptor: | 7 |
H bond donor: | 2 |
Smile: | CC(C)(CCCCn1c(=O)c2c(nc[nH]2)n(c1=O)C)O |
InChi: | InChI=1S/C13H20N4O3/c1-13(2,20)6-4-5-7-17-11(18)9-10(15-8-14-9)16(3)12(17)19/h8,20H,4-7H2,1-3H3,(H,14,15) |
InChiKey: | InChIKey=NWXULHNEYYFVMF-UHFFFAOYSA-N |
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