小分子和化合物库

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  1. 雌三醇-d3
      规格或纯度 :
    • ≥95 atom% D,≥95%(HPLC)
    CAS号: 79037-36-8
    分子式: C18H21D3O3        分子量: 291.4
    IUPAC Name: (8R,13S,17R)-2,4,17-trideuterio-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,16,17-triol
    SMILES: CC12CCC3C(C1CC(C2O)O)CCC4=C3C=CC(=C4)O
    InChIKey: PROQIPRRNZUXQM-JFORYDAQSA-N
    InChI: 1S/C18H24O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)21/h3,5,8,13-17,19-21H,2,4,6-7,9H2,1H3/t13?,14-,15?,16?,17+,18+/m1/s1/i3D,8D,17D
  2. 法尼费醇 A
      规格或纯度 :
    • ≥85%(NMR)
    CAS号: 511-33-1
    分子式: C24H30O4        分子量: 382.49
    IUPAC Name: 7-[[(1S,4aS,6R,8aR)-6-hydroxy-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]methoxy]chromen-2-one
    SMILES: CC1(C2CCC(=C)C(C2(CCC1O)C)COC3=CC4=C(C=C3)C=CC(=O)O4)C
    InChIKey: FCWYNTDTQPCVPG-WTMJVXIESA-N
    InChI: 1S/C24H30O4/c1-15-5-9-20-23(2,3)21(25)11-12-24(20,4)18(15)14-27-17-8-6-16-7-10-22(26)28-19(16)13-17/h6-8,10,13,18,20-21,25H,1,5,9,11-12,14H2,2-4H3/t18-,20+,21+,24-/m0/s1
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