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咖啡君
Cafedrine
CAS号: 58166-83-9
IUPAC名称: 7-[2-[[(1R,2S)-1-hydroxy-1-phenylpropan-2-yl]amino]ethyl]-1,3-dimethylpurine-2,6-dione
分子式: C18H23N5O3
分子量: 357.40700
InChI: InChI=1S/C18H23N5O3/c1-12(15(24)13-7-5-4-6-8-13)19-9-10-23-11-20-16-14(23)17(25)22(3)18(26)21(16)2/h4-8,11-12,15,19,24H,9-10H2,1-3H3/t12-,15-/m0/s1
InChIKey: UJSKUDDDPKGBJY-WFASDCNBSA-N
SMILES: C[C@@H]([C@@H](C1=CC=CC=C1)O)NCCN2C=NC3=C2C(=O)N(C(=O)N3C)C
EINECS: -
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