代谢酶/蛋白酶 - 按“信号通路”分类 - 小分子和化合物库

美伐他汀

规格或纯度 :

≥96%(HPLC)

CAS号: 73573-88-3

分子式: C₂₃H₃₄O₅ 分子量: 390.51

IUPAC Name: [(1S,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-7-methyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] (2S)-2-methylbutanoate

SMILES: CCC(C)C(=O)OC1CCC=C2C1C(C(C=C2)C)CCC3CC(CC(=O)O3)O

InChIKey: AJLFOPYRIVGYMJ-INTXDZFKSA-N

InChI: 1S/C23H34O5/c1-4-14(2)23(26)28-20-7-5-6-16-9-8-15(3)19(22(16)20)11-10-18-12-17(24)13-21(25)27-18/h6,8-9,14-15,17-20,22,24H,4-5,7,10-13H2,1-3H3/t14-,15-,17+,18+,19-,20-,22-/m0/s1

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尿苷-5′-二磷酸二钠盐水合物

规格或纯度 :

≥96%(HPLC)

CAS号: 27821-45-0 EC号: 248-678-9 Compound CID : 11957711

分子式: C₉H₁₂N₂Na₂O₁₂P₂·xH₂O 分子量: 448.12 (anhydrous basis)

IUPAC Name: disodium;[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] hydrogen phosphate

SMILES: C1=CN(C(=O)NC1=O)C2C(C(C(O2)COP(=O)([O-])OP(=O)(O)[O-])O)O.[Na+].[Na+]

InChIKey: ZQKVPFKBNNAXCE-WFIJOQBCSA-L

InChI: 1S/C9H14N2O12P2.2Na/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18;;/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18);;/q;2*+1/p-2/t4-,6-,7-,8-;;/m1../s1

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β-胡萝卜素

规格或纯度 :

Moligand™

≥96%(HPLC)

CAS号: 7235-40-7 EC号: 230-636-6

分子式: C₄₀H₅₆ 分子量: 536.87

IUPAC Name: 1,3,3-trimethyl-2-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethylcyclohexen-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohexene

SMILES: CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC2=C(CCCC2(C)C)C)C)C

InChIKey: OENHQHLEOONYIE-JLTXGRSLSA-N

InChI: 1S/C40H56/c1-31(19-13-21-33(3)25-27-37-35(5)23-15-29-39(37,7)8)17-11-12-18-32(2)20-14-22-34(4)26-28-38-36(6)24-16-30-40(38,9)10/h11-14,17-22,25-28H,15-16,23-24,29-30H2,1-10H3/b12-11+,19-13+,20-14+,27-See more

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大黄素

规格或纯度 :

分析标准品

≥96%(HPLC)

CAS号: 518-82-1

分子式: C₁₅H₁₀O₅ 分子量: 270.24

IUPAC Name: 1,3,8-trihydroxy-6-methylanthracene-9,10-dione

SMILES: CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)O

InChIKey: RHMXXJGYXNZAPX-UHFFFAOYSA-N

InChI: 1S/C15H10O5/c1-6-2-8-12(10(17)3-6)15(20)13-9(14(8)19)4-7(16)5-11(13)18/h2-5,16-18H,1H3

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非瑟酮

规格或纯度 :

Moligand™

≥96%(HPLC)

CAS号: 528-48-3

分子式: C₁₅H₁₀O₆ 分子量: 286.24

IUPAC Name: 2-(3,4-dihydroxyphenyl)-3,7-dihydroxychromen-4-one

SMILES: C1=CC(=C(C=C1C2=C(C(=O)C3=C(O2)C=C(C=C3)O)O)O)O

InChIKey: XHEFDIBZLJXQHF-UHFFFAOYSA-N

InChI: 1S/C15H10O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,16-18,20H

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模绕酮酸

规格或纯度 :

≥96%(HPLC)

CAS号: 6713-27-5

分子式: C₃₀H₄₆O₃ 分子量: 454.7

IUPAC Name: (4aS,6aR,6aR,6bR,8aR,12aR,14aS)-2,2,6a,6b,9,9,12a-heptamethyl-10-oxo-4,5,6,6a,7,8,8a,11,12,13,14,14a-dodecahydro-3H-picene-4a-carboxylic acid

SMILES: CC1(CCC2(CCC3(C(C2=C1)CCC4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C)C(=O)O)C

InChIKey: UMYJVVZWBKIXQQ-QALSDZMNSA-N

InChI: 1S/C30H46O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h18-19,21-22H,8-17H2,1-7H3,(H,32,33)/t19-,21+,22-,27+,28-,29-,30+/m1/s1

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4-叔丁基杯[4]芳烃-O,O',O'',O'''-四乙酸四乙酯

规格或纯度 :

≥96%(HPLC)

CAS号: 97600-39-0 Compound CID : 2724889

分子式: C₆₀H₈₀O₁₂ 分子量: 993.29

IUPAC Name: ethyl 2-[[5,11,17,23-tetratert-butyl-26,27,28-tris(2-ethoxy-2-oxoethoxy)-25-pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3,5,7(28),9,11,13(27),15(26),16,18,21(25),22-dodecaenyl]oxy]acetate

SMILES: CCOC(=O)COC1=C2CC3=CC(=CC(=C3OCC(=O)OCC)CC4=C(C(=CC(=C4)C(C)(C)C)CC5=C(C(=CC(=C5)C(C)(C)C)CC1=CC(=C2)C(C)(C)C)OCC(=O)OCC)OCC(=O)OCC)C(C)(C)C

InChIKey: HZHADWCIBZZJNV-UHFFFAOYSA-N

InChI: 1S/C60H80O12/c1-17-65-49(61)33-69-53-37-21-39-27-46(58(8,9)10)29-41(54(39)70-34-50(62)66-18-2)23-43-31-48(60(14,15)16)32-44(56(43)72-36-52(64)68-20-4)24-42-30-47(59(11,12)13)28-40(55(42)71-35-51(63)67See more

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人参皂苷CK

规格或纯度 :

≥96%(HPLC)

CAS号: 39262-14-1

分子式: C₃₆H₆₂O₈ 分子量: 622.87

IUPAC Name: (2S,3R,4S,5S,6R)-2-[(2S)-2-[(3S,5R,8R,9R,10R,12R,13R,14R,17S)-3,12-dihydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-5-en-2-ylSee more

SMILES: CC(=CCCC(C)(C1CCC2(C1C(CC3C2(CCC4C3(CCC(C4(C)C)O)C)C)O)C)OC5C(C(C(C(O5)CO)O)O)O)C

InChIKey: FVIZARNDLVOMSU-IRFFNABBSA-N

InChI: 1S/C36H62O8/c1-20(2)10-9-14-36(8,44-31-30(42)29(41)28(40)23(19-37)43-31)21-11-16-35(7)27(21)22(38)18-25-33(5)15-13-26(39)32(3,4)24(33)12-17-34(25,35)6/h10,21-31,37-42H,9,11-19H2,1-8H3/t21-,22+,23+,24-See more

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L-抗坏血酸-2-磷酸三钠盐

规格或纯度 :

≥96%(HPLC)

CAS号: 66170-10-3

分子式: C₆H₆Na₃O₉P· xH₂O 分子量: 322.05 (anhydrous basis)

IUPAC Name: trisodium;[(2R)-2-[(1S)-1,2-dihydroxyethyl]-3-oxido-5-oxo-2H-furan-4-yl] phosphate

SMILES: C(C(C1C(=C(C(=O)O1)OP(=O)([O-])[O-])[O-])O)O.[Na+].[Na+].[Na+]

InChIKey: YRWWOAFMPXPHEJ-OFBPEYICSA-K

InChI: 1S/C6H9O9P.3Na/c7-1-2(8)4-3(9)5(6(10)14-4)15-16(11,12)13;;;/h2,4,7-9H,1H2,(H2,11,12,13);;;/q;3*+1/p-3/t2-,4+;;;/m0.../s1

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Y-29794 草酸盐

规格或纯度 :

≥96%(HPLC)

CAS号: 146794-84-5 Compound CID : 45073463

分子式: C₂₃H₃₄N₂OS₂•C₂H₂O₄ 分子量: 508.69

IUPAC Name: [2-[8-(dimethylamino)octylsulfanyl]-6-propan-2-ylpyridin-3-yl]-thiophen-2-ylmethanone;oxalic acid

SMILES: CC(C)C1=NC(=C(C=C1)C(=O)C2=CC=CS2)SCCCCCCCCN(C)C.C(=O)(C(=O)O)O

InChIKey: UUSSHPPSOUAHHP-UHFFFAOYSA-N

InChI: 1S/C23H34N2OS2.C2H2O4/c1-18(2)20-14-13-19(22(26)21-12-11-17-27-21)23(24-20)28-16-10-8-6-5-7-9-15-25(3)4;3-1(4)2(5)6/h11-14,17-18H,5-10,15-16H2,1-4H3;(H,3,4)(H,5,6)

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D-葡萄糖-1,2,3,4,5,6,6-d7

规格或纯度 :

≥97 atom% D,≥97%

CAS号: 23403-54-5

分子式: C₆H₅D₇O₆ 分子量: 187.2

IUPAC Name: (3R,4S,5S,6R)-2,3,4,5,6-pentadeuterio-6-[dideuterio(hydroxy)methyl]oxane-2,3,4,5-tetrol

SMILES: C(C1C(C(C(C(O1)O)O)O)O)O

InChIKey: WQZGKKKJIJFFOK-QCQRZMBHSA-N

InChI: InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6?/m1/s1/i1D2,2D,3D,4D,5D,6D

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维生素D₃(6,19,19-d₃)溶液

规格或纯度 :

≥97 atom% D,≥97%
1mg/mL in ethanol

CAS号: 80666-48-4 EC号: 200-673-2 (unlabeled)

分子式: C₂₇D₃H₄₁O 分子量: 387.66

IUPAC Name: (1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]-1-deuterioethylidene]-4-(dideuteriomethylidene)cyclohexan-1-ol

SMILES: CC(C)CCCC(C)C1CCC2C1(CCCC2=CC=C3CC(CCC3=C)O)C

InChIKey: QYSXJUFSXHHAJI-GLSUUORTSA-N

InChI: 1S/C27H44O/c1-19(2)8-6-9-21(4)25-15-16-26-22(10-7-17-27(25,26)5)12-13-23-18-24(28)14-11-20(23)3/h12-13,19,21,24-26,28H,3,6-11,14-18H2,1-2,4-5H3/b22-12+,23-13-/t21-,24+,25-,26+,27-/m1/s1/i3D2,13D

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