按“信号通路”分类 - 小分子和化合物库 | 纯度: ≥99 atom% 13C, ≥95%, ≥97%

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芦荟大黄素
- ≥95%
CAS号 : 481-72-1 Compound CID : 10207

分子式: C₁₅H₁₀O₅ 分子量: 270.24

IUPAC Name: 1,8-dihydroxy-3-(hydroxymethyl)anthracene-9,10-dione

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

InChIKey: YDQWDHRMZQUTBA-UHFFFAOYSA-N

InChI: InChI=1S/C15H10O5/c16-6-7-4-9-13(11(18)5-7)15(20)12-8(14(9)19)2-1-3-10(12)17/h1-5,16-18H,6H2
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3-氨基-2-噁唑烷酮(AOZ)
- ≥97%
CAS号 : 80-65-9 Compound CID : 65725

分子式: C₃H₆N₂O₂ 分子量: 102.09

IUPAC Name: 3-amino-1,3-oxazolidin-2-one

SMILES: C1COC(=O)N1N

InChIKey: KYCJNIUHWNJNCT-UHFFFAOYSA-N

InChI: InChI=1S/C3H6N2O2/c4-5-1-2-7-3(5)6/h1-2,4H2
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DL-3-氨基丁酸
- ≥97%
CAS号 : 541-48-0 Compound CID : 10932

分子式: C₄H₉NO₂ 分子量: 103.12

IUPAC Name: 3-aminobutanoic acid

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

InChIKey: OQEBBZSWEGYTPG-UHFFFAOYSA-N

InChI: InChI=1S/C4H9NO2/c1-3(5)2-4(6)7/h3H,2,5H2,1H3,(H,6,7)
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Barasertib (AZD1152-HQPA),Aurora B激酶抑制剂
- ≥97%
CAS号 : 722544-51-6 Compound CID : 16007391

分子式: C₂₆H₃₀FN₇O₃ 分子量: 507.56

IUPAC Name: 2-[3-[[7-[3-[ethyl(2-hydroxyethyl)amino]propoxy]quinazolin-4-yl]amino]-1H-pyrazol-5-yl]-N-(3-fluorophenyl)acetamide

SMILES: CCN(CCCOC1=CC2=C(C=C1)C(=NC=N2)NC3=NNC(=C3)CC(=O)NC4=CC(=CC=C4)F)CCO

InChIKey: QYZOGCMHVIGURT-UHFFFAOYSA-N

InChI: InChI=1S/C26H30FN7O3/c1-2-34(10-11-35)9-4-12-37-21-7-8-22-23(16-21)28-17-29-26(22)31-24-14-20(32-33-24)15-25(36)30-19-6-3-5-18(27)13-19/h3,5-8,13-14,16-17,35H,2,4,9-12,15H2,1H3,(H,30,36)(H2,28,29,31,32,33)
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3-氨基丙烷磺酸
- ≥97%
CAS号 : 3687-18-1 Compound CID : 1646

分子式: C₃H₉NO₃S 分子量: 139.17

IUPAC Name: 3-aminopropane-1-sulfonic acid

SMILES: C(CN)CS(=O)(=O)O

InChIKey: SNKZJIOFVMKAOJ-UHFFFAOYSA-N

InChI: InChI=1S/C3H9NO3S/c4-2-1-3-8(5,6)7/h1-4H2,(H,5,6,7)
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安帕莱克斯
- ≥95%
CAS号 : 154235-83-3 Compound CID : 148184

分子式: C₁₄H₁₅N₃O 分子量: 241.29

IUPAC Name: piperidin-1-yl(quinoxalin-6-yl)methanone

SMILES: C1CCN(CC1)C(=O)C2=CC3=NC=CN=C3C=C2

InChIKey: ANDGGVOPIJEHOF-UHFFFAOYSA-N

InChI: InChI=1S/C14H15N3O/c18-14(17-8-2-1-3-9-17)11-4-5-12-13(10-11)16-7-6-15-12/h4-7,10H,1-3,8-9H2
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阿仑膦酸钠三水合物
- ≥97%
CAS号 : 121268-17-5 Compound CID : 23681107

分子式: C₄H₁₂NaNO₇P₂·3H₂O 分子量: 325.12

IUPAC Name: sodium;(4-amino-1-hydroxy-1-phosphonobutyl)-hydroxyphosphinate;trihydrate

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

InChIKey: DCSBSVSZJRSITC-UHFFFAOYSA-M

InChI: InChI=1S/C4H13NO7P2.Na.3H2O/c5-3-1-2-4(6,13(7,8)9)14(10,11)12;;;;/h6H,1-3,5H2,(H2,7,8,9)(H2,10,11,12);;3*1H2/q;+1;;;/p-1
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ASC-J9,二甲基姜黄素
- ≥95%
CAS号 : 52328-98-0 Compound CID : 6477182

分子式: C₂₃H₂₄O₆ 分子量: 396.43

IUPAC Name: (1E,4Z,6E)-1,7-bis(3,4-dimethoxyphenyl)-5-hydroxyhepta-1,4,6-trien-3-one

SMILES: COC1=C(C=C(C=C1)C=CC(=CC(=O)C=CC2=CC(=C(C=C2)OC)OC)O)OC

InChIKey: ZMGUKFHHNQMKJI-CIOHCNBKSA-N

InChI: InChI=1S/C23H24O6/c1-26-20-11-7-16(13-22(20)28-3)5-9-18(24)15-19(25)10-6-17-8-12-21(27-2)23(14-17)29-4/h5-15,24H,1-4H3/b9-5+,10-6+,18-15-
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1-氨基环丁烷羧酸
- ≥97%
CAS号 : 22264-50-2

分子式: H₂NC₄H₆CO₂H 分子量: 115.13

IUPAC Name: 1-aminocyclobutane-1-carboxylic acid

SMILES: C1CC(C1)(C(=O)O)N

InChIKey: FVTVMQPGKVHSEY-UHFFFAOYSA-N

InChI: InChI=1S/C5H9NO2/c6-5(4(7)8)2-1-3-5/h1-3,6H2,(H,7,8)
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阿法替尼
- ≥95%
CAS号 : 439081-18-2 Compound CID : 10184653

分子式: C₂₄H₂₅ClFN₅O₃ 分子量: 485.94

IUPAC Name: (E)-N-[4-(3-chloro-4-fluoroanilino)-7-[(3S)-oxolan-3-yl]oxyquinazolin-6-yl]-4-(dimethylamino)but-2-enamide

SMILES: CN(C)CC=CC(=O)NC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=C(C=C3)F)Cl)OC4CCOC4

InChIKey: ULXXDDBFHOBEHA-CWDCEQMOSA-N

InChI: InChI=1S/C24H25ClFN5O3/c1-31(2)8-3-4-23(32)30-21-11-17-20(12-22(21)34-16-7-9-33-13-16)27-14-28-24(17)29-15-5-6-19(26)18(25)10-15/h3-6,10-12,14,16H,7-9,13H2,1-2H3,(H,30,32)(H,27,28,29)/b4-3+/t16-/m0/s1
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3-氨基-4-羟基苯甲酸
- ≥97%
CAS号 : 1571-72-8 Compound CID : 65083

分子式: C₇H₇NO₃ 分子量: 153.14

IUPAC Name: 3-amino-4-hydroxybenzoic acid

SMILES: C1=CC(=C(C=C1C(=O)O)N)O

InChIKey: MRBKRZAPGUCWOS-UHFFFAOYSA-N

InChI: InChI=1S/C7H7NO3/c8-5-3-4(7(10)11)1-2-6(5)9/h1-3,9H,8H2,(H,10,11)
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长川霉素
- ≥97%
CAS号 : 104987-12-4 Compound CID : 5282071

分子式: C₄₃H₆₉NO₁₂ 分子量: 792.01

IUPAC Name: (1R,9S,12S,13R,14S,17R,18E,21S,23S,24R,25S,27R)-17-ethyl-1,14-dihydroxy-12-[(E)-1-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]prop-1-en-2-yl]-23,25-dimethoxy-13,19,21,27-tetramethyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone

SMILES: CCC1C=C(CC(CC(C2C(CC(C(O2)(C(=O)C(=O)N3CCCCC3C(=O)OC(C(C(CC1=O)O)C)C(=CC4CCC(C(C4)OC)O)C)O)C)OC)OC)C)C

InChIKey: ZDQSOHOQTUFQEM-NURRSENYSA-N

InChI: InChI=1S/C43H69NO12/c1-10-30-18-24(2)17-25(3)19-36(53-8)39-37(54-9)21-27(5)43(51,56-39)40(48)41(49)44-16-12-11-13-31(44)42(50)55-38(28(6)33(46)23-34(30)47)26(4)20-29-14-15-32(45)35(22-29)52-7/h18,20,25,27-33,35-39,45-46,51H,10-17,19,21-23H2,1-9H3/b24-18+,26-20+/t25-,27+,28+,29-,30+,31-,32+,33-,35+,36-,37-,38+,39+,43+/m0/s1
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