小分子和化合物库

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显示第4960个,产品总数113

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  1. 切布甙Ⅱ
      规格或纯度 :
    • ≥95%(LC/MS-ELSD)
    CAS号: 149475-28-5
    分子量: 666.84
    SMILES: CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5[C@H](O)C[C@@]34C)[C@@H]2C1)C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O
    InChIKey: DZVIFFMYEULLBY-ZBNHRINCSA-N
    InChI: 1S/C36H58O11/c1-31(2)9-11-36(30(45)47-29-26(43)25(42)24(41)22(16-37)46-29)12-10-34(5)18(19(36)13-31)7-8-23-32(3)14-21(40)28(44)33(4,17-38)27(32)20(39)15-35(23,34)6/h7,19-29,37-44H,8-17H2,1-6H3/t19-,20See more
  2. 刺五加乙
      规格或纯度 :
    • ≥95%(LC/MS-ELSD)
    CAS号: 194851-33-7
    分子量: 568.52
    SMILES: COc1cccc2cc3C(=O)O[C@H](C)c3c(O[C@@H]4O[C@H](CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c12
    InChIKey: PAEOIXITAYMQRF-ZAEQARNUSA-N
    InChI: 1S/C26H32O14/c1-9-15-11(24(34)37-9)6-10-4-3-5-12(35-2)16(10)23(15)40-26-22(33)20(31)18(29)14(39-26)8-36-25-21(32)19(30)17(28)13(7-27)38-25/h3-6,9,13-14,17-22,25-33H,7-8H2,1-2H3/t9-,13-,14-,17-,18-,19+See more
  3. 哥伦宾
      规格或纯度 :
    • ≥95%(LC/MS-ELSD)
    CAS号: 546-97-4
    分子式: C20H22O6        分子量: 358.39
    IUPAC Name: (1R,2S,3S,5S,8R,11R,12R)-5-(furan-3-yl)-12-hydroxy-3,11-dimethyl-6,14-dioxatetracyclo[10.2.2.02,11.03,8]hexadec-15-ene-7,13-dione
    SMILES: CC12CCC3C(=O)OC(CC3(C1C4C=CC2(C(=O)O4)O)C)C5=COC=C5
    InChIKey: AALLCALQGXXWNA-QJNFORGASA-N
    InChI: 1S/C20H22O6/c1-18-9-14(11-5-8-24-10-11)25-16(21)12(18)3-6-19(2)15(18)13-4-7-20(19,23)17(22)26-13/h4-5,7-8,10,12-15,23H,3,6,9H2,1-2H3/t12-,13+,14-,15-,18+,19+,20-/m0/s1
  4. 地黄皂苷B
      规格或纯度 :
    • ≥95%(LC/MS-ELSD)
    CAS号: 151466-56-7        Compound CID : 56776246
    分子式: C41H64O15        分子量: 796.94
    IUPAC Name: (3S,4S,6aR,6bS,8R,8aR,12aS,14bR)-8-hydroxy-4,6a,6b,11,11,14b-hexamethyl-8a-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycarbonyl-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-1,2,See more
    SMILES: CC1(CCC2(C(C1)C3=CCC4C5(CCC(C(C5CCC4(C3(CC2O)C)C)(C)C(=O)O)OC6C(C(C(CO6)O)O)O)C)C(=O)OC7C(C(C(C(O7)CO)O)O)O)C
    InChIKey: ARNBRPDSKOETGW-BWRWHWAYSA-N
    InChI: 1S/C41H64O15/c1-36(2)13-14-41(35(52)56-33-31(49)29(47)28(46)22(17-42)54-33)20(15-36)19-7-8-23-37(3)11-10-26(55-32-30(48)27(45)21(43)18-53-32)40(6,34(50)51)24(37)9-12-38(23,4)39(19,5)16-25(41)44/h7,20-See more
  5. 坎地酮
      规格或纯度 :
    • ≥95%(LC/MS-ELSD)
    CAS号: 77727-18-5
    分子式: C22H24O4        分子量: 352.42
    IUPAC Name: (2S)-5,7-dimethoxy-8-(3-methylbut-2-enyl)-2-phenyl-2,3-dihydrochromen-4-one
    SMILES: CC(=CCC1=C2C(=C(C=C1OC)OC)C(=O)CC(O2)C3=CC=CC=C3)C
    InChIKey: JYESOAFLKFHYHP-SFHVURJKSA-N
    InChI: 1S/C22H24O4/c1-14(2)10-11-16-19(24-3)13-20(25-4)21-17(23)12-18(26-22(16)21)15-8-6-5-7-9-15/h5-10,13,18H,11-12H2,1-4H3/t18-/m0/s1
  6. 大沙人
      规格或纯度 :
    • ≥95%(LC/MS-ELSD)
    CAS号: 482-53-1
    分子式: C25H24O5        分子量: 404.46
    IUPAC Name: 5-hydroxy-3-(4-hydroxyphenyl)-8,8-dimethyl-6-(3-methylbut-2-enyl)pyrano[2,3-h]chromen-4-one
    SMILES: CC(=CCC1=C2C(=C3C(=C1O)C(=O)C(=CO3)C4=CC=C(C=C4)O)C=CC(O2)(C)C)C
    InChIKey: DCTLJGWMHPGCOS-UHFFFAOYSA-N
    InChI: 1S/C25H24O5/c1-14(2)5-10-17-21(27)20-22(28)19(15-6-8-16(26)9-7-15)13-29-24(20)18-11-12-25(3,4)30-23(17)18/h5-9,11-13,26-27H,10H2,1-4H3
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