小分子和化合物库

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显示第4960个,产品总数146

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  1. 8-O-4-羟基肉桂酰哈帕格特
      规格或纯度 :
    • ≥95%(LC/MS-ELSD)
    CAS号: 133645-37-1        Compound CID : 133053422
    分子式: C24H30O12        分子量: 510.49
    IUPAC Name: [(4aS,5R,7S)-4a,5-dihydroxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5,6,7a-tetrahydrocyclopenta[c]pyran-7-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
    SMILES: CC1(CC(C2(C1C(OC=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O)OC(=O)C=CC4=CC=C(C=C4)O
    InChIKey: AZKQDXZMKREFDY-KZAOYDMLSA-N
    InChI: 1S/C24H30O12/c1-23(36-16(28)7-4-12-2-5-13(26)6-3-12)10-15(27)24(32)8-9-33-22(20(23)24)35-21-19(31)18(30)17(29)14(11-25)34-21/h2-9,14-15,17-22,25-27,29-32H,10-11H2,1H3/b7-4+/t14-,15-,17-,18+,19-,20?,21See more
  2. 8-羟基松脂醇-4'-O-β-D-吡喃葡萄糖苷
      规格或纯度 :
    • ≥95%(LC/MS-ELSD)
    CAS号: 102582-69-4        Compound CID : 21591950
    分子式: C26H32O12        分子量: 536.53
    IUPAC Name: (2S,3R,4S,5S,6R)-2-[4-[(3R,3aS,6S,6aR)-3a-hydroxy-3-(4-hydroxy-3-methoxyphenyl)-3,4,6,6a-tetrahydro-1H-furo[3,4-c]furan-6-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
    SMILES: COC1=C(C=CC(=C1)C2C3COC(C3(CO2)O)C4=CC(=C(C=C4)O)OC)OC5C(C(C(C(O5)CO)O)O)O
    InChIKey: GQLQVPZSTWXDBQ-ZOKOZUFBSA-N
    InChI: 1S/C26H32O12/c1-33-17-8-13(3-5-15(17)28)24-26(32)11-36-23(14(26)10-35-24)12-4-6-16(18(7-12)34-2)37-25-22(31)21(30)20(29)19(9-27)38-25/h3-8,14,19-25,27-32H,9-11H2,1-2H3/t14-,19-,20-,21+,22-,23-,24-,25-See more
  3. Aceroside VII
      规格或纯度 :
    • ≥95%(LC/MS-ELSD)
    CAS号: 104109-45-7
    分子式: C25H34O8        分子量: 462.53
    IUPAC Name: (2S,3S,4R,5R,6S)-2-[1,7-bis(4-hydroxyphenyl)heptan-3-yloxy]-6-(hydroxymethyl)oxane-3,4,5-triol
    SMILES: C1=CC(=CC=C1CCCCC(CCC2=CC=C(C=C2)O)OC3C(C(C(C(O3)CO)O)O)O)O
    InChIKey: MAUAGULXOHJIER-MVMXRKHSSA-N
    InChI: 1S/C25H34O8/c26-15-21-22(29)23(30)24(31)25(33-21)32-20(14-9-17-7-12-19(28)13-8-17)4-2-1-3-16-5-10-18(27)11-6-16/h5-8,10-13,20-31H,1-4,9,14-15H2/t20?,21-,22-,23+,24-,25-/m0/s1
  4. Bayogenin-3-O-β-D-葡萄糖醛酸吡喃糖苷-28-O-β-D-吡喃葡萄糖基酯
      规格或纯度 :
    • ≥95%(LC/MS-ELSD)
    CAS号: 178248-96-9
    分子量: 826.96
    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@@H]6O[C@@H]([C@@H](O)[C@H](O)[C@H]6O)C(O)=O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O
    InChIKey: YQDXYGOKFNYKCJ-RQBYSGHOSA-N
    InChI: 1S/C42H66O16/c1-37(2)11-13-42(36(54)58-34-29(50)26(47)25(46)22(17-43)55-34)14-12-40(5)19(20(42)15-37)7-8-24-38(3)16-21(45)32(39(4,18-44)23(38)9-10-41(24,40)6)57-35-30(51)27(48)28(49)31(56-35)33(52)53/See more
  5. Dactylorhin E
      规格或纯度 :
    • ≥95%(LC/MS-ELSD)
    CAS号: 256459-40-2
    分子式: C27H40O16        分子量: 620.6
    IUPAC Name: (3S)-5-methyl-3-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[[4-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methoxycarbonyl]hexanoic acid
    SMILES: CC(C)CC(CC(=O)O)(C(=O)OCC1=CC=C(C=C1)OC2C(C(C(C(O2)CO)O)O)O)OC3C(C(C(C(O3)CO)O)O)O
    InChIKey: ZGNUJHGCJSHIQU-JNGALJFKSA-N
    InChI: 1S/C27H40O16/c1-12(2)7-27(8-17(30)31,43-25-23(37)21(35)19(33)16(10-29)42-25)26(38)39-11-13-3-5-14(6-4-13)40-24-22(36)20(34)18(32)15(9-28)41-24/h3-6,12,15-16,18-25,28-29,32-37H,7-11H2,1-2H3,(H,30,31)/tSee more
  6. Hellebrigenin-3-O-β-glucoside
      规格或纯度 :
    • ≥95%(LC/MS-ELSD)
    CAS号: 72947-90-1        Compound CID : 3055779
    分子式: C30H42O11        分子量: 578.65
    IUPAC Name: (3S,5S,8R,9S,10S,13R,14S,17R)-5,14-dihydroxy-13-methyl-17-(6-oxopyran-3-yl)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[aSee more
    SMILES: CC12CCC3C(C1(CCC2C4=COC(=O)C=C4)O)CCC5(C3(CCC(C5)OC6C(C(C(C(O6)CO)O)O)O)C=O)O
    InChIKey: AXUYMUBJXHVZEL-DBOUUHTQSA-N
    InChI: 1S/C30H42O11/c1-27-8-5-19-20(30(27,38)11-7-18(27)16-2-3-22(33)39-14-16)6-10-29(37)12-17(4-9-28(19,29)15-32)40-26-25(36)24(35)23(34)21(13-31)41-26/h2-3,14-15,17-21,23-26,31,34-38H,4-13H2,1H3/t17-,18+,1See more
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