小分子和化合物库

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显示第8596个,产品总数114

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  1. 硝基四氢萘
      规格或纯度 :
    • ≥95%(LC/MS-ELSD)
    CAS号: 50656-78-5
    分子式: C24H30O7        分子量: 430.49
    IUPAC Name: (5R,6S,7S)-5-(3,4-dimethoxyphenyl)-4-methoxy-6,7-bis(methoxymethyl)-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole
    SMILES: COCC1CC2=CC3=C(C(=C2C(C1COC)C4=CC(=C(C=C4)OC)OC)OC)OCO3
    InChIKey: LHQDZANQXMRHIV-LZJOCLMNSA-N
    InChI: 1S/C24H30O7/c1-25-11-16-8-15-10-20-23(31-13-30-20)24(29-5)22(15)21(17(16)12-26-2)14-6-7-18(27-3)19(9-14)28-4/h6-7,9-10,16-17,21H,8,11-13H2,1-5H3/t16-,17-,21+/m1/s1
  2. 穿心莲甙
      规格或纯度 :
    • ≥95%(LC/MS-ELSD)
    CAS号: 82209-76-5        Compound CID : 6439612
    分子式: C26H40O10        分子量: 512.59
    IUPAC Name: (3E,4S)-3-[2-[(4aS,5R,6R,8aS)-6-hydroxy-5,8a-dimethyl-2-methylidene-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]-4-See more
    SMILES: CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)COC4C(C(C(C(O4)CO)O)O)O)O
    InChIKey: VUEPOIYXKZTLMD-JXJPMOHRSA-N
    InChI: 1S/C26H40O10/c1-13-4-7-18-25(2,15(13)6-5-14-16(28)11-34-23(14)33)9-8-19(29)26(18,3)12-35-24-22(32)21(31)20(30)17(10-27)36-24/h5,15-22,24,27-32H,1,4,6-12H2,2-3H3/b14-5+/t15?,16-,17-,18+,19-,20-,21+,22-See more
  3. 糖苷
      规格或纯度 :
    • ≥95%(LC/MS-ELSD)
    CAS号: 14215-86-2        Compound CID : 161036
    分子式: C16H22O9        分子量: 358.34
    IUPAC Name: (3S,4R,4aS)-4-ethenyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-8-one
    SMILES: C=CC1C2CCOC(=O)C2=COC1OC3C(C(C(C(O3)CO)O)O)O
    InChIKey: VSJGJMKGNMDJCI-ZASXJUAOSA-N
    InChI: 1S/C16H22O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2,6-8,10-13,15-20H,1,3-5H2/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1
  4. 红木甙C
      规格或纯度 :
    • ≥95%(LC/MS-ELSD)
    CAS号: 39491-37-7
    分子式: C38H58O12        分子量: 706.86
    IUPAC Name: (2S,3R,4R,5R,6S)-2-[(2S,3R,4S,5S)-4,5-dihydroxy-2-[(1S,2S,4S,6R,7S,8R,9S,12S,13R,14R,16R)-16-hydroxy-7,9,13-trimethyl-5'-methylidenespiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxaneSee more
    SMILES: CC1C2C(CC3C2(CCC4C3CC=C5C4(C(CC(C5)O)OC6C(C(C(CO6)O)O)OC7C(C(C(C(O7)C)O)O)O)C)C)OC18CCC(=C)CO8
    InChIKey: URTQATADKAKTAX-RFJPXPNDSA-N
    InChI: 1S/C38H58O12/c1-17-8-11-38(46-15-17)18(2)28-26(50-38)14-24-22-7-6-20-12-21(39)13-27(37(20,5)23(22)9-10-36(24,28)4)48-35-33(30(42)25(40)16-45-35)49-34-32(44)31(43)29(41)19(3)47-34/h6,18-19,21-35,39-44HSee more
  5. 维普赛德
      规格或纯度 :
    • ≥95%(LC/MS-ELSD)
    CAS号: 50932-20-2        Compound CID : 12000799
    分子式: C22H26O13        分子量: 498.43
    IUPAC Name: [(1S,2S,4S,5S,6R,10S)-2-(hydroxymethyl)-10-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-5-yl] 3,4-dihydroxybenzoate
    SMILES: C1=COC(C2C1C(C3C2(O3)CO)OC(=O)C4=CC(=C(C=C4)O)O)OC5C(C(C(C(O5)CO)O)O)O
    InChIKey: DBUOUVZMYWYRRI-YWEKDMGLSA-N
    InChI: 1S/C22H26O13/c23-6-12-14(27)15(28)16(29)21(32-12)34-20-13-9(3-4-31-20)17(18-22(13,7-24)35-18)33-19(30)8-1-2-10(25)11(26)5-8/h1-5,9,12-18,20-21,23-29H,6-7H2/t9-,12-,13-,14-,15+,16-,17+,18+,20+,21+,22-/See more
  6. 维罗尼考苷
      规格或纯度 :
    • ≥95%(LC/MS-ELSD)
    CAS号: 50981-09-4        Compound CID : 13848081
    分子式: C22H26O11        分子量: 466.44
    IUPAC Name: [(1S,2S,4S,5S,6R,10S)-2-(hydroxymethyl)-10-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-5-yl] benzoate
    SMILES: C1=CC=C(C=C1)C(=O)OC2C3C=COC(C3C4(C2O4)CO)OC5C(C(C(C(O5)CO)O)O)O
    InChIKey: GOHHRVCULPSXEU-RWORTQBESA-N
    InChI: 1S/C22H26O11/c23-8-12-14(25)15(26)16(27)21(30-12)32-20-13-11(6-7-29-20)17(18-22(13,9-24)33-18)31-19(28)10-4-2-1-3-5-10/h1-7,11-18,20-21,23-27H,8-9H2/t11-,12-,13-,14-,15+,16-,17+,18+,20+,21+,22-/m1/s1
  7. 维那丁
      规格或纯度 :
    • ≥95%(LC/MS-ELSD)
    CAS号: 477-32-7        Compound CID : 442151
    分子式: C21H24O7        分子量: 388.41
    IUPAC Name: [(9R,10R)-10-acetyloxy-8,8-dimethyl-2-oxo-9,10-dihydropyrano[2,3-f]chromen-9-yl] (2R)-2-methylbutanoate
    SMILES: CCC(C)C(=O)OC1C(C2=C(C=CC3=C2OC(=O)C=C3)OC1(C)C)OC(=O)C
    InChIKey: GVBNSPFBYXGREE-CXWAGAITSA-N
    InChI: 1S/C21H24O7/c1-6-11(2)20(24)27-19-18(25-12(3)22)16-14(28-21(19,4)5)9-7-13-8-10-15(23)26-17(13)16/h7-11,18-19H,6H2,1-5H3/t11-,18-,19-/m1/s1
  8. 罗根酸
      规格或纯度 :
    • ≥95%(LC/MS-ELSD)
    CAS号: 22255-40-9
    分子式: C16H24O10        分子量: 376.36
    IUPAC Name: (1S,4aS,6S,7R,7aS)-6-hydroxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid
    SMILES: CC1C(CC2C1C(OC=C2C(=O)O)OC3C(C(C(C(O3)CO)O)O)O)O
    InChIKey: JNNGEAWILNVFFD-CDJYTOATSA-N
    InChI: 1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1
  9. 聚半乳糖苷A
      规格或纯度 :
    • ≥95%(LC/MS-ELSD)
    CAS号: 914111-18-5        Compound CID : 133556549
    分子式: C19H26O11        分子量: 430.4
    IUPAC Name: [(2S,3S,4R,5S,6R)-6-[(3R,4R,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl benzoate
    SMILES: C1C(C(C(C(O1)CO)O)O)OC2C(C(C(C(O2)COC(=O)C3=CC=CC=C3)O)O)O
    InChIKey: RXRSNDCGNOOFLH-PZRMXHSFSA-N
    InChI: 1S/C19H26O11/c20-6-10-13(21)14(22)11(7-27-10)29-19-17(25)16(24)15(23)12(30-19)8-28-18(26)9-4-2-1-3-5-9/h1-5,10-17,19-25H,6-8H2/t10-,11+,12-,13-,14-,15+,16+,17-,19+/m0/s1
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