按“信号通路”分类 - 小分子和化合物库 | 纯度: ≥98 atom% 15N,≥98.5%, ≥93%, ≥98 atom% D,≥98%

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阿立哌唑-d8(Butyl-d8)
- ≥98 atom% D,≥98%
CAS号 : 1089115-04-7 Compound CID : 25144831

分子式: C₂₃D₈H₁₉Cl₂N₃O₂ 分子量: 456.43

IUPAC Name: 7-[1,1,2,2,3,3,4,4-octadeuterio-4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy]-3,4-dihydro-1H-quinolin-2-one

SMILES: C1CC(=O)NC2=C1C=CC(=C2)OCCCCN3CCN(CC3)C4=C(C(=CC=C4)Cl)Cl

InChIKey: CEUORZQYGODEFX-BQLKVSHCSA-N

InChI: InChI=1S/C23H27Cl2N3O2/c24-19-4-3-5-21(23(19)25)28-13-11-27(12-14-28)10-1-2-15-30-18-8-6-17-7-9-22(29)26-20(17)16-18/h3-6,8,16H,1-2,7,9-15H2,(H,26,29)/i1D2,2D2,10D2,15D2
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3-羟基-3-甲基戊二酸
- ≥93%
CAS号 : 503-49-1 Compound CID : 1662

分子式: C₆H₁₀O₅ 分子量: 162.14

IUPAC Name: 3-hydroxy-3-methylpentanedioic acid

SMILES: CC(CC(=O)O)(CC(=O)O)O

InChIKey: NPOAOTPXWNWTSH-UHFFFAOYSA-N

InChI: InChI=1S/C6H10O5/c1-6(11,2-4(7)8)3-5(9)10/h11H,2-3H2,1H3,(H,7,8)(H,9,10)
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DL-异柠檬酸三钠盐水合物
- ≥93%
CAS号 : 1637-73-6 Compound CID : 168942

分子式: C₆H₅O₇Na₃·xH₂O 分子量: 258.07 (anhydrous basis)

IUPAC Name: trisodium;1-hydroxypropane-1,2,3-tricarboxylate

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

InChIKey: HWMVXEKEEAIYGB-UHFFFAOYSA-K

InChI: InChI=1S/C6H8O7.3Na/c7-3(8)1-2(5(10)11)4(9)6(12)13;;;/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13);;;/q;3*+1/p-3
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L-异亮氨酸-15N
- ≥98 atom% 15N,≥98.5%
CAS号 : 59935-30-7 Compound CID : 10678279

分子式: C₆H₁₃15NO₂ 分子量: 132.17

IUPAC Name: (2S,3S)-2-(15N)azanyl-3-methylpentanoic acid

SMILES: CCC(C)C(C(=O)O)N

InChIKey: AGPKZVBTJJNPAG-NNXLWEQRSA-N

InChI: InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5-/m0/s1/i7+1
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L-丙氨酸-15N
- ≥98 atom% 15N,≥98.5%
CAS号 : 25713-23-9 Compound CID : 11815285

分子式: C₃H₇15NO₂ 分子量: 90.09

IUPAC Name: (2S)-2-(15N)azanylpropanoic acid

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

InChIKey: QNAYBMKLOCPYGJ-GZPBOPPUSA-N

InChI: InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/i4+1
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α-L-天冬酰胺-15N 一水合物
- ≥98 atom% 15N,≥98.5%
CAS号 : 204451-47-8 Compound CID : 522362

分子式: C₄H₈15NNO₃· H₂O 分子量: 151.13

IUPAC Name: 2,4-diamino-4-oxobutanoic acid;hydrate

SMILES: C(C(C(=O)O)N)C(=O)N.O

InChIKey: RBMGJIZCEWRQES-UHFFFAOYSA-N

InChI: InChI=1S/C4H8N2O3.H2O/c5-2(4(8)9)1-3(6)7;/h2H,1,5H2,(H2,6,7)(H,8,9);1H2
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胆固醇壬酸酯
- ≥93%
CAS号 : 1182-66-7 Compound CID : 2723614

分子式: C₃₆H₆₂O₂ 分子量: 526.89

IUPAC Name: [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] nonanoate

SMILES: CCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C

InChIKey: WCLNGBQPTVENHV-MKQVXYPISA-N

InChI: InChI=1S/C36H62O2/c1-7-8-9-10-11-12-16-34(37)38-29-21-23-35(5)28(25-29)17-18-30-32-20-19-31(27(4)15-13-14-26(2)3)36(32,6)24-22-33(30)35/h17,26-27,29-33H,7-16,18-25H2,1-6H3/t27-,29+,30+,31-,32+,33+,35+,36-/m1/s1
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1,4-屈醌
- ≥93%
CAS号 : 100900-16-1

分子式: C₁₈H₁₀O₂ 分子量: 258.28

IUPAC Name: chrysene-1,4-dione

SMILES: C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3C(=O)C=CC4=O

InChIKey: UORKIKBNUWJNJF-UHFFFAOYSA-N

InChI: InChI=1S/C18H10O2/c19-16-9-10-17(20)18-14-6-5-11-3-1-2-4-12(11)13(14)7-8-15(16)18/h1-10H
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苯甲酸-2,3,4,5,6-d5
- ≥98 atom% D,≥98%
CAS号 : 1079-02-3 Compound CID : 71603

分子式: C₆D₅CO₂H 分子量: 127.15

IUPAC Name: 2,3,4,5,6-pentadeuteriobenzoic acid

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

InChIKey: WPYMKLBDIGXBTP-RALIUCGRSA-N

InChI: InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)/i1D,2D,3D,4D,5D
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盐酸头孢甲肟
- ≥93%
CAS号 : 75738-58-8 Compound CID : 11954009

分子式: C₃₂H₃₄N₁₈O₁₀S₆·HCl 分子量: 1059.58

IUPAC Name: (6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid;hydrochloride

SMILES: CN1C(=NN=N1)SCC2=C(N3C(C(C3=O)NC(=O)C(=NOC)C4=CSC(=N4)N)SC2)C(=O)O.CN1C(=NN=N1)SCC2=C(N3C(C(C3=O)NC(=O)C(=NOC)C4=CSC(=N4)N)SC2)C(=O)O.Cl

InChIKey: MPTNDTIREFCQLK-UNVJPQNDSA-N

InChI: InChI=1S/2C16H17N9O5S3.ClH/c2*1-24-16(20-22-23-24)33-4-6-3-31-13-9(12(27)25(13)10(6)14(28)29)19-11(26)8(21-30-2)7-5-32-15(17)18-7;/h2*5,9,13H,3-4H2,1-2H3,(H2,17,18)(H,19,26)(H,28,29);1H/b2*21-8-;/t2*9-,13-;/m11./s1
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褪黑素D4
- ≥98 atom% D,≥98%
CAS号 : 66521-38-8 Compound CID : 12358981

分子式: C₁₃H₁₂D₄N₂O₂ 分子量: 236.3

IUPAC Name: N-[1,1,2,2-tetradeuterio-2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide

SMILES: CC(=O)NCCC1=CNC2=C1C=C(C=C2)OC

InChIKey: DRLFMBDRBRZALE-NZLXMSDQSA-N

InChI: InChI=1S/C13H16N2O2/c1-9(16)14-6-5-10-8-15-13-4-3-11(17-2)7-12(10)13/h3-4,7-8,15H,5-6H2,1-2H3,(H,14,16)/i5D2,6D2
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西布特罗-D9
- ≥98 atom% D,≥98%
CAS号 : 1246819-04-4 Compound CID : 71312591

分子式: C₁₃H₁₀D₉N₃O 分子量: 242.36

IUPAC Name: 2-amino-5-[2-[[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]amino]-1-hydroxyethyl]benzonitrile

SMILES: CC(C)(C)NCC(C1=CC(=C(C=C1)N)C#N)O

InChIKey: YKKQAXQGZIBJFS-GQALSZNTSA-N

InChI: InChI=1S/C13H19N3O/c1-13(2,3)16-8-12(17)9-4-5-11(15)10(6-9)7-14/h4-6,12,16-17H,8,15H2,1-3H3/i1D3,2D3,3D3
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