5-Iodo-7-(2-C-methyl-beta-D-ribofuranosyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
한글명:5-Iodo-7-(2-C-methyl-beta-D-ribofuranosyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
카스 번호847551-49-9
상품명:5-Iodo-7-(2-C-methyl-beta-D-ribofuranosyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CBNumberCB91509273
분자식C12H15IN4O4
포뮬러 무게406.17637
MOL 파일847551-49-9.mol
화학적 성질
끓는 점 | 675.7±55.0 °C(Predicted) |
밀도 | 2.28±0.1 g/cm3(Predicted) |
산도 계수 (pKa) | 12.39±0.70(Predicted) |
InChI | InChI=1/C12H15IN4O4/c1-12(20)8(19)6(3-18)21-11(12)17-2-5(13)7-9(14)15-4-16-10(7)17/h2,4,6,8,11,18-20H,3H2,1H3,(H2,14,15,16)/t6-,8-,11-,12-/s3 |
InChIKey | VDPOJGOZLKLNFY-PMMCFNNLNA-N |
SMILES | O1[C@H](CO)[C@@H](O)[C@@](C)(O)[C@@H]1N1C2=C(C(I)=C1)C(N)=NC=N2 |&1:1,4,6,9,r| |