按“信号通路”分类 - 小分子和化合物库 | 纯度: ≥99.5%(HPLC), ≥99 atom% D, ≥92%(HPLC)

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α-细辛脑
- ≥99.5%(HPLC)
CAS号 : 2883-98-9 Compound CID : 636822

分子式: C₁₂H₁₆O₃ 分子量: 208.25

IUPAC Name: 1,2,4-trimethoxy-5-[(E)-prop-1-enyl]benzene

SMILES: CC=CC1=CC(=C(C=C1OC)OC)OC

InChIKey: RKFAZBXYICVSKP-AATRIKPKSA-N

InChI: InChI=1S/C12H16O3/c1-5-6-9-7-11(14-3)12(15-4)8-10(9)13-2/h5-8H,1-4H3/b6-5+
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腺嘌呤
- ≥99.5%(HPLC)
CAS号 : 73-24-5

分子式: C₅H₅N₅ 分子量: 135.13

IUPAC Name: 7H-purin-6-amine

SMILES: Nc1ncnc2[nH]cnc12

InChIKey: GFFGJBXGBJISGV-UHFFFAOYSA-N

InChI: InChI=1S/C5H5N5/c6-4-3-5(9-1-7-3)10-2-8-4/h1-2H,(H3,6,7,8,9,10)
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烟酸
- ≥99.5%(HPLC)
CAS号 : 59-67-6 Compound CID : 938

分子式: C₆H₅NO₂ 分子量: 123.11

IUPAC Name: pyridine-3-carboxylic acid

SMILES: C1=CC(=CN=C1)C(=O)O

InChIKey: PVNIIMVLHYAWGP-UHFFFAOYSA-N

InChI: InChI=1S/C6H5NO2/c8-6(9)5-2-1-3-7-4-5/h1-4H,(H,8,9)
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烟酰胺
- ≥99.5%(HPLC)
CAS号 : 98-92-0 Compound CID : 936

分子式: C₆H₆N₂O 分子量: 122.12

IUPAC Name: pyridine-3-carboxamide

SMILES: C1=CC(=CN=C1)C(=O)N

InChIKey: DFPAKSUCGFBDDF-UHFFFAOYSA-N

InChI: InChI=1S/C6H6N2O/c7-6(9)5-2-1-3-8-4-5/h1-4H,(H2,7,9)
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烟酰胺
- ≥99.5%(HPLC)
CAS号 : 98-92-0 Compound CID : 936

分子式: C₆H₆N₂O 分子量: 122.12

IUPAC Name: pyridine-3-carboxamide

SMILES: C1=CC(=CN=C1)C(=O)N

InChIKey: DFPAKSUCGFBDDF-UHFFFAOYSA-N

InChI: InChI=1S/C6H6N2O/c7-6(9)5-2-1-3-8-4-5/h1-4H,(H2,7,9)
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D-核糖
- ≥99.5%(HPLC)
CAS号 : 50-69-1 Compound CID : 5311110

分子式: C₅H₁₀O₅ 分子量: 150.13

IUPAC Name: (2R,3R,4R)-2,3,4,5-tetrahydroxypentanal

SMILES: C(C(C(C(C=O)O)O)O)O

InChIKey: PYMYPHUHKUWMLA-LMVFSUKVSA-N

InChI: InChI=1S/C5H10O5/c6-1-3(8)5(10)4(9)2-7/h1,3-5,7-10H,2H2/t3-,4+,5-/m0/s1
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D-山梨醇
- ≥99.5%(HPLC)
CAS号 : 50-70-4

分子式: C₆H₁₄O₆ 分子量: 182.18

IUPAC Name: (2R,3R,4R,5S)-hexane-1,2,3,4,5,6-hexol

SMILES: OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CO

InChIKey: FBPFZTCFMRRESA-JGWLITMVSA-N

InChI: InChI=1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4+,5-,6-/m1/s1
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D-山梨醇
- ≥99.5%(HPLC)
CAS号 : 50-70-4

分子式: C₆H₁₄O₆ 分子量: 182.18

IUPAC Name: (2R,3R,4R,5S)-hexane-1,2,3,4,5,6-hexol

SMILES: OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CO

InChIKey: FBPFZTCFMRRESA-JGWLITMVSA-N

InChI: InChI=1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4+,5-,6-/m1/s1
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头孢噻肟钠盐
- ≥99.5%(HPLC)
CAS号 : 64485-93-4 Compound CID : 10695961

分子式: C₁₆H₁₆N₅NaO₇S₂ 分子量: 477.45

IUPAC Name: sodium;(6R,7R)-3-(acetyloxymethyl)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

SMILES: CC(=O)OCC1=C(N2C(C(C2=O)NC(=O)C(=NOC)C3=CSC(=N3)N)SC1)C(=O)[O-].[Na+]

InChIKey: AZZMGZXNTDTSME-JUZDKLSSSA-M

InChI: InChI=1S/C16H17N5O7S2.Na/c1-6(22)28-3-7-4-29-14-10(13(24)21(14)11(7)15(25)26)19-12(23)9(20-27-2)8-5-30-16(17)18-8;/h5,10,14H,3-4H2,1-2H3,(H2,17,18)(H,19,23)(H,25,26);/q;+1/p-1/b20-9-;/t10-,14-;/m1./s1
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4-氯-3-甲基苯酚
- ≥99.5%(HPLC)
CAS号 : 59-50-7 Compound CID : 1732

分子式: C₇H₇ClO 分子量: 142.58

IUPAC Name: 4-chloro-3-methylphenol

SMILES: CC1=C(C=CC(=C1)O)Cl

InChIKey: CFKMVGJGLGKFKI-UHFFFAOYSA-N

InChI: InChI=1S/C7H7ClO/c1-5-4-6(9)2-3-7(5)8/h2-4,9H,1H3
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西维因
- ≥99.5%(HPLC)
CAS号 : 63-25-2 Compound CID : 6129

分子式: C₁₂H₁₁NO₂ 分子量: 201.22

IUPAC Name: naphthalen-1-yl N-methylcarbamate

SMILES: CNC(=O)OC1=CC=CC2=CC=CC=C21

InChIKey: CVXBEEMKQHEXEN-UHFFFAOYSA-N

InChI: InChI=1S/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)
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洋地黄毒苷
- ≥92%(HPLC)
CAS号 : 71-63-6 Compound CID : 441207

分子式: C₄₁H₆₄O₁₃ 分子量: 764.94

IUPAC Name: 3-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-[(2R,4S,5S,6R)-5-[(2S,4S,5S,6R)-5-[(2S,4S,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-4-hydroxy-6-methyloxan-2-yl]oxy-4-hydroxy-6-methyloxan-2-yl]oxy-14-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one

SMILES: CC1C(C(CC(O1)OC2C(OC(CC2O)OC3C(OC(CC3O)OC4CCC5(C(C4)CCC6C5CCC7(C6(CCC7C8=CC(=O)OC8)O)C)C)C)C)O)O

InChIKey: WDJUZGPOPHTGOT-XUDUSOBPSA-N

InChI: InChI=1S/C41H64O13/c1-20-36(46)29(42)16-34(49-20)53-38-22(3)51-35(18-31(38)44)54-37-21(2)50-33(17-30(37)43)52-25-8-11-39(4)24(15-25)6-7-28-27(39)9-12-40(5)26(10-13-41(28,40)47)23-14-32(45)48-19-23/h14,20-22,24-31,33-38,42-44,46-47H,6-13,15-19H2,1-5H3/t20-,21-,22-,24-,25+,26-,27+,28-,29+,30+,31+,33+,34+,35+,36-,37-,38-,39+,40-,41+/m1/s1
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