按“信号通路”分类 - 小分子和化合物库 | 纯度: ≥95 atom% D,≥95%, ≥99 atom% 13C,≥98%, ≥97.5%(HPLC)

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D-葡萄糖-2-¹³C
- ≥99 atom% 13C,≥98%
CAS号 : 105931-74-6 Compound CID : 12285870

分子式: C6H12O6 分子量: 181.15

IUPAC Name: (3R,4S,5S,6R)-6-(hydroxymethyl)(313C)oxane-2,3,4,5-tetrol

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

InChIKey: WQZGKKKJIJFFOK-UKLRSMCWSA-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/i5+1
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吴茱萸内酯
- ≥97.5%(HPLC)
CAS号 : 1180-71-8 Compound CID : 179651

分子式: C₂₆H₃₀O₈ 分子量: 470.51

IUPAC Name: (1R,2R,7S,10R,13R,14R,16S,19S,20S)-19-(furan-3-yl)-9,9,13,20-tetramethyl-4,8,15,18-tetraoxahexacyclo[11.9.0.02,7.02,10.014,16.014,20]docosane-5,12,17-trione

SMILES: CC1(C2CC(=O)C3(C(C24COC(=O)CC4O1)CCC5(C36C(O6)C(=O)OC5C7=COC=C7)C)C)C

InChIKey: KBDSLGBFQAGHBE-MSGMIQHVSA-N

InChI: InChI=1S/C26H30O8/c1-22(2)15-9-16(27)24(4)14(25(15)12-31-18(28)10-17(25)33-22)5-7-23(3)19(13-6-8-30-11-13)32-21(29)20-26(23,24)34-20/h6,8,11,14-15,17,19-20H,5,7,9-10,12H2,1-4H3/t14-,15-,17-,19-,20+,23-,24-,25+,26+/m0/s1
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亚油酸-1-13C
- ≥99 atom% 13C,≥98%
CAS号 : 98353-71-0 Compound CID : 12311286

分子式: C₁₇13CH₃₂O₂ 分子量: 281.44

IUPAC Name: (9Z,12Z)-(113C)octadeca-9,12-dienoic acid

SMILES: CCCCCC=CCC=CCCCCCCCC(=O)O

InChIKey: OYHQOLUKZRVURQ-LKLZSCEKSA-N

InChI: InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6-,10-9-/i18+1
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甘氨脱氧胆酸-2,2,4,4-d4
- ≥95 atom% D,≥95%
CAS号 : 1069132-37-1 Compound CID : 71309868

分子式: C₂₆H₃₉D₄NO₅ 分子量: 453.65

IUPAC Name: 2-[[(4R)-4-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-2,2,4,4-tetradeuterio-3,12-dihydroxy-10,13-dimethyl-3,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]acetic acid

SMILES: CC(CCC(=O)NCC(=O)O)C1CCC2C1(C(CC3C2CCC4C3(CCC(C4)O)C)O)C

InChIKey: WVULKSPCQVQLCU-JHVXYEQYSA-N

InChI: InChI=1S/C26H43NO5/c1-15(4-9-23(30)27-14-24(31)32)19-7-8-20-18-6-5-16-12-17(28)10-11-25(16,2)21(18)13-22(29)26(19,20)3/h15-22,28-29H,4-14H2,1-3H3,(H,27,30)(H,31,32)/t15-,16-,17-,18+,19-,20+,21+,22+,25+,26-/m1/s1/i10D2,12D2
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D-[UL-¹³C6]甘露醇
- ≥99 atom% 13C,≥98%
CAS号 : 287112-34-9

分子式: (13C)₆H₁₄O₆ 分子量: 188.13

IUPAC Name: (2R,3R,4R,5R)-(1,2,3,4,5,6-13C6)hexane-1,2,3,4,5,6-hexol

SMILES: C(C(C(C(C(CO)O)O)O)O)O

InChIKey: FBPFZTCFMRRESA-CRWJSTOYSA-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/i1+1,2+1,3+1,4+1,5+1,6+1
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D-葡萄糖-¹³C₆
- ≥99 atom% 13C,≥98%
CAS号 : 110187-42-3 Compound CID : 3086538

分子式: 13C₆H₁₂O₆ 分子量: 186.11

IUPAC Name: 2,3,4,5,6-pentahydroxy(1,2,3,4,5,6-13C6)hexanal

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

InChIKey: GZCGUPFRVQAUEE-IDEBNGHGSA-N

InChI: InChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h1,3-6,8-12H,2H2/i1+1,2+1,3+1,4+1,5+1,6+1
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L-[6-¹³C]岩藻糖
- ≥99 atom% 13C,≥98%
CAS号 : 478518-51-3 Compound CID : 90472747

分子式: 13CC₅H₁₂O₅ 分子量: 165.15

IUPAC Name: (3S,4R,5S,6S)-6-(113C)methyloxane-2,3,4,5-tetrol

SMILES: CC1C(C(C(C(O1)O)O)O)O

InChIKey: SHZGCJCMOBCMKK-BUCMHYPRSA-N

InChI: InChI=1S/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3+,4+,5-,6?/m0/s1/i1+1
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Nudifloramide-d3
- ≥95 atom% D,≥95%
CAS号 : 1207384-48-2 Compound CID : 71751269

分子式: C₇H₅D₃N₂O₂ 分子量: 155.17

IUPAC Name: 6-oxo-1-(trideuteriomethyl)pyridine-3-carboxamide

SMILES: CN1C=C(C=CC1=O)C(=O)N

InChIKey: JLQSXXWTCJPCBC-FIBGUPNXSA-N

InChI: InChI=1S/C7H8N2O2/c1-9-4-5(7(8)11)2-3-6(9)10/h2-4H,1H3,(H2,8,11)/i1D3
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丙烯酰胺-¹³C₃
- ≥99 atom% 13C,≥98%
CAS号 : 287399-26-2 Compound CID : 71308872

分子式: 13C₃H₅NO 分子量: 74.06

IUPAC Name: (1,2,3-13C3)prop-2-enamide

SMILES: C=CC(=O)N

InChIKey: HRPVXLWXLXDGHG-VMIGTVKRSA-N

InChI: InChI=1S/C3H5NO/c1-2-3(4)5/h2H,1H2,(H2,4,5)/i1+1,2+1,3+1
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叶酸-d4
- ≥95 atom% D,≥95%
CAS号 : 171777-72-3 Compound CID : 136219942

分子式: C₁₉H₁₅D₄N₇O₆ 分子量: 445.42

IUPAC Name: (2S)-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]-2,3,5,6-tetradeuteriobenzoyl]amino]pentanedioic acid

SMILES: C1=CC(=CC=C1C(=O)NC(CCC(=O)O)C(=O)O)NCC2=CN=C3C(=N2)C(=O)NC(=N3)N

InChIKey: OVBPIULPVIDEAO-ALIZGMTFSA-N

InChI: InChI=1S/C19H19N7O6/c20-19-25-15-14(17(30)26-19)23-11(8-22-15)7-21-10-3-1-9(2-4-10)16(29)24-12(18(31)32)5-6-13(27)28/h1-4,8,12,21H,5-7H2,(H,24,29)(H,27,28)(H,31,32)(H3,20,22,25,26,30)/t12-/m0/s1/i1D,2D,3D,4D
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尼洛替尼-d3
- ≥95 atom% D,≥95%
CAS号 : 1215678-43-5 Compound CID : 49849405

分子式: C₂₈H₁₉D₃F₃N₇O 分子量: 532.53

IUPAC Name: 4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]-N-[3-[4-(trideuteriomethyl)imidazol-1-yl]-5-(trifluoromethyl)phenyl]benzamide

SMILES: CC1=C(C=C(C=C1)C(=O)NC2=CC(=CC(=C2)C(F)(F)F)N3C=C(N=C3)C)NC4=NC=CC(=N4)C5=CN=CC=C5

InChIKey: HHZIURLSWUIHRB-BMSJAHLVSA-N

InChI: InChI=1S/C28H22F3N7O/c1-17-5-6-19(10-25(17)37-27-33-9-7-24(36-27)20-4-3-8-32-14-20)26(39)35-22-11-21(28(29,30)31)12-23(13-22)38-15-18(2)34-16-38/h3-16H,1-2H3,(H,35,39)(H,33,36,37)/i2D3
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氨氯地平-d4马来酸盐
- ≥95 atom% D,≥95%
CAS号 : 1185246-15-4

分子式: C₂₄H₂₅D₄ClN₂O₉ 分子量: 528.97

IUPAC Name: (Z)-but-2-enedioic acid;3-O-ethyl 5-O-methyl 2-[(2-amino-1,1,2,2-tetradeuterioethoxy)methyl]-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate

SMILES: NC([2H])([2H])C([2H])([2H])OCC1=C(C(OCC)=O)C(C2=CC=CC=C2Cl)C(C(OC)=O)=C(C)N1.O=C(O)/C=C\C(O)=O

InChIKey: TZNOWAJJWCGILX-IBTKSTAFSA-N

InChI: InChI=1S/C20H25ClN2O5.C4H4O4/c1-4-28-20(25)18-15(11-27-10-9-22)23-12(2)16(19(24)26-3)17(18)13-7-5-6-8-14(13)21;5-3(6)1-2-4(7)8/h5-8,17,23H,4,9-11,22H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/i9D2,10D2;
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