页面 2 | 按“信号通路”分类 - 小分子和化合物库

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弧蛋白
- ≥95%(LC/MS-ELSD)
CAS号 : 20362-31-6 Compound CID : 100528

分子式: C₂₇H₃₄O₁₁ 分子量: 534.55

IUPAC Name: (3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]-3-[[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]oxolan-2-one

SMILES: COC1=C(C=C(C=C1)CC2COC(=O)C2CC3=CC(=C(C=C3)OC4C(C(C(C(O4)CO)O)O)O)OC)OC

InChIKey: XOJVHLIYNSOZOO-SWOBOCGESA-N

InChI: InChI=1S/C27H34O11/c1-33-18-6-4-14(10-20(18)34-2)8-16-13-36-26(32)17(16)9-15-5-7-19(21(11-15)35-3)37-27-25(31)24(30)23(29)22(12-28)38-27/h4-7,10-11,16-17,22-25,27-31H,8-9,12-13H2,1-3H3/t16-,17+,22+,23+,24-,25+,27+/m0/s1
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木犀草素7-芸香苷
- ≥95%(LC/MS-ELSD)
CAS号 : 20633-84-5 Compound CID : 10461109

分子式: C₂₇H₃₀O₁₅ 分子量: 594.52

IUPAC Name: 2-(3,4-dihydroxyphenyl)-5-hydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one

SMILES: CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC(=C4C(=C3)OC(=CC4=O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O)O

InChIKey: MGYBYJXAXUBTQF-FOBVWLSUSA-N

InChI: InChI=1S/C27H30O15/c1-9-20(32)22(34)24(36)26(39-9)38-8-18-21(33)23(35)25(37)27(42-18)40-11-5-14(30)19-15(31)7-16(41-17(19)6-11)10-2-3-12(28)13(29)4-10/h2-7,9,18,20-30,32-37H,8H2,1H3/t9-,18+,20-,21+,22+,23-,24+,25+,26+,27+/m0/s1
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梓苷
- ≥95%(LC/MS-ELSD)
CAS号 : 6736-85-2 Compound CID : 93039

分子式: C₂₂H₂₆O₁₂ 分子量: 482.43

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] 4-hydroxybenzoate

SMILES: C1=COC(C2C1C(C3C2(O3)CO)OC(=O)C4=CC=C(C=C4)O)OC5C(C(C(C(O5)CO)O)O)O

InChIKey: UXSACQOOWZMGSE-RWORTQBESA-N

InChI: InChI=1S/C22H26O12/c23-7-12-14(26)15(27)16(28)21(31-12)33-20-13-11(5-6-30-20)17(18-22(13,8-24)34-18)32-19(29)9-1-3-10(25)4-2-9/h1-6,11-18,20-21,23-28H,7-8H2/t11-,12-,13-,14-,15+,16-,17+,18+,20+,21+,22-/m1/s1
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白环素
- ≥95%(LC/MS-ELSD)
CAS号 : 25129-91-3 Compound CID : 6440973

分子式: C₁₈H₂₈O₄ 分子量: 308.41

IUPAC Name: (3E,5R,6E,8S,9E,13S,14R)-5-hydroxy-8-methoxy-5,9,13,14-tetramethyl-1-oxacyclotetradeca-3,6,9-trien-2-one

SMILES: CC1CCC=C(C(C=CC(C=CC(=O)OC1C)(C)O)OC)C

InChIKey: BYWWNDLILWPPJP-REXWONOSSA-N

InChI: InChI=1S/C18H28O4/c1-13-7-6-8-14(2)16(21-5)9-11-18(4,20)12-10-17(19)22-15(13)3/h8-13,15-16,20H,6-7H2,1-5H3/b11-9+,12-10+,14-8+/t13-,15+,16-,18+/m0/s1
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石蜡苷A
- ≥95%(LC/MS-ELSD)
CAS号 : 84744-28-5 Compound CID : 5273566

分子式: C₂₃H₂₆O₁₁ 分子量: 478.45

IUPAC Name: [(2R,3S,4R,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate

SMILES: C1=CC(=C(C=C1CCOC2C(C(C(C(O2)CO)OC(=O)C=CC3=CC(=C(C=C3)O)O)O)O)O)O

InChIKey: UHIGZYLCYRQESL-VJWFJHQPSA-N

InChI: InChI=1S/C23H26O11/c24-11-18-22(34-19(29)6-3-12-1-4-14(25)16(27)9-12)20(30)21(31)23(33-18)32-8-7-13-2-5-15(26)17(28)10-13/h1-6,9-10,18,20-28,30-31H,7-8,11H2/b6-3+/t18-,20-,21-,22-,23-/m1/s1
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穆匹酰胺
- ≥95%(LC/MS-ELSD)
CAS号 : 66648-43-9 Compound CID : 5280537

分子式: C₁₈H₁₉NO₄ 分子量: 313.35

IUPAC Name: (E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide

SMILES: COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CC=C(C=C2)O)O

InChIKey: NPNNKDMSXVRADT-WEVVVXLNSA-N

InChI: InChI=1S/C18H19NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-9,12,20-21H,10-11H2,1H3,(H,19,22)/b9-5+
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胡椒碱
- ≥95%(LC/MS-ELSD)
CAS号 : 23512-46-1 Compound CID : 5320618

分子式: C₁₇H₂₁NO₃ 分子量: 287.35

IUPAC Name: (E)-5-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylpent-2-en-1-one

SMILES: C1CCN(CC1)C(=O)C=CCCC2=CC3=C(C=C2)OCO3

InChIKey: QHWOFMXDKFORMO-XVNBXDOJSA-N

InChI: InChI=1S/C17H21NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h3,7-9,12H,1-2,4-6,10-11,13H2/b7-3+
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苯甲醛-C
- ≥95%(LC/MS-ELSD)
CAS号 : 157047-98-8 Compound CID : 190865

分子式: C₂₄H₁₇N₃O₃ 分子量: 395.41

IUPAC Name: 6'-methyl-3-phenylspiro[oxirane-2,7'-quinazolino[3,2-a][1,4]benzodiazepine]-5',13'-dione

SMILES: CN1C(=O)C2=CC=CC=C2N3C(=O)C4=CC=CC=C4N=C3C15C(O5)C6=CC=CC=C6

InChIKey: TWDKBDSVUUKABK-UHFFFAOYSA-N

InChI: InChI=1S/C24H17N3O3/c1-26-21(28)17-12-6-8-14-19(17)27-22(29)16-11-5-7-13-18(16)25-23(27)24(26)20(30-24)15-9-3-2-4-10-15/h2-14,20H,1H3
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阿琼糖苷Ⅰ
- ≥95%(LC/MS-ELSD)
CAS号 : 62319-70-4 Compound CID : 14658050

分子式: C₃₆H₅₈O₁₁ 分子量: 666.84

IUPAC Name: [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1S,4aR,6aR,6aS,6bR,8aR,9R,10R,11R,12aR,14bS)-1,10,11-trihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate

SMILES: CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1O)C)C(=O)OC6C(C(C(C(O6)CO)O)O)O)C

InChIKey: CMZFNIMQBCBHEX-APNSOIJXSA-N

InChI: InChI=1S/C36H58O11/c1-31(2)11-13-36(30(45)47-29-26(42)25(41)24(40)20(16-37)46-29)14-12-34(5)18(23(36)28(31)44)7-8-22-32(3)15-19(39)27(43)33(4,17-38)21(32)9-10-35(22,34)6/h7,19-29,37-44H,8-17H2,1-6H3/t19-,20-,21-,22-,23-,24-,25+,26-,27+,28+,29+,32+,33+,34-,35-,36+/m1/s1
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