按“信号通路”分类 - 小分子和化合物库 | 纯度: ≥99 atom% 13C, ≥65%, ≥94%

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碘化丙锭（PI）
- ≥94%
CAS号 : 25535-16-4 Compound CID : 104981

分子式: C₂₇H₃₄I₂N₄ 分子量: 668.39

IUPAC Name: 3-(3,8-diamino-6-phenylphenanthridin-5-ium-5-yl)propyl-diethyl-methylazanium;diiodide

SMILES: CC[N+](C)(CC)CCC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N)N.[I-].[I-]

InChIKey: XJMOSONTPMZWPB-UHFFFAOYSA-M

InChI: InChI=1S/C27H33N4.2HI/c1-4-31(3,5-2)17-9-16-30-26-19-22(29)13-15-24(26)23-14-12-21(28)18-25(23)27(30)20-10-7-6-8-11-20;;/h6-8,10-15,18-19,29H,4-5,9,16-17,28H2,1-3H3;2*1H/q+1;;/p-1
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菜油甾醇
- ≥65%
CAS号 : 474-62-4 Compound CID : 173183

分子式: C₂₈H₄₈O 分子量: 400.68

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

SMILES: CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C

InChIKey: SGNBVLSWZMBQTH-PODYLUTMSA-N

InChI: InChI=1S/C28H48O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h9,18-20,22-26,29H,7-8,10-17H2,1-6H3/t19-,20-,22+,23+,24-,25+,26+,27+,28-/m1/s1
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姜黄素
- ≥65%
CAS号 : 458-37-7 Compound CID : 969516

分子式: C₂₁H₂₀O₆ 分子量: 368.38

IUPAC Name: (1E,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione

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

InChIKey: VFLDPWHFBUODDF-FCXRPNKRSA-N

InChI: InChI=1S/C21H20O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h3-12,24-25H,13H2,1-2H3/b7-3+,8-4+
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4,4'-二苯胺基-1,1'-联萘-5,5'-二磺酸二钾盐
- ≥94%
CAS号 : 65664-81-5 Compound CID : 16213473

分子式: C₃₂H₂₂K₂N₂O₆S₂ 分子量: 672.85

IUPAC Name: dipotassium;8-anilino-5-(4-anilino-5-sulfonatonaphthalen-1-yl)naphthalene-1-sulfonate

SMILES: C1=CC=C(C=C1)NC2=C3C(=C(C=C2)C4=C5C=CC=C(C5=C(C=C4)NC6=CC=CC=C6)S(=O)(=O)[O-])C=CC=C3S(=O)(=O)[O-].[K+].[K+]

InChIKey: VWLWTJHKQHRTNC-UHFFFAOYSA-L

InChI: InChI=1S/C32H24N2O6S2.2K/c35-41(36,37)29-15-7-13-25-23(17-19-27(31(25)29)33-21-9-3-1-4-10-21)24-18-20-28(34-22-11-5-2-6-12-22)32-26(24)14-8-16-30(32)42(38,39)40;;/h1-20,33-34H,(H,35,36,37)(H,38,39,40);;/q;2*+1/p-2
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D -葡萄糖-1-¹³C
- ≥99 atom% 13C
CAS号 : 40762-22-9 Compound CID : 12285878

分子式: 13CC₅H₁₂O₆ 分子量: 181.15

IUPAC Name: (3R,4S,5S,6R)-6-(hydroxymethyl)(213C)oxane-2,3,4,5-tetrol

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

InChIKey: WQZGKKKJIJFFOK-USBRANDWSA-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/i6+1
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甘氨酸-2-13C
- ≥99 atom% 13C
CAS号 : 20220-62-6 Compound CID : 11105298

分子式: H₂N13CH₂CO₂H 分子量: 76.06

IUPAC Name: 2-aminoacetic acid

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

InChIKey: DHMQDGOQFOQNFH-OUBTZVSYSA-N

InChI: InChI=1S/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5)/i1+1
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6-叔-丁基-2,3-萘二甲腈
- ≥94%
CAS号 : 32703-82-5 Compound CID : 613000

分子式: C₁₆H₁₄N₂ 分子量: 234.3

IUPAC Name: 6-tert-butylnaphthalene-2,3-dicarbonitrile

SMILES: CC(C)(C)C1=CC2=CC(=C(C=C2C=C1)C#N)C#N

InChIKey: MKILROQBJOOZKC-UHFFFAOYSA-N

InChI: InChI=1S/C16H14N2/c1-16(2,3)15-5-4-11-6-13(9-17)14(10-18)7-12(11)8-15/h4-8H,1-3H3
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(-)-假木贼碱
- ≥94%
CAS号 : 494-52-0

分子式: C₁₀H₁₄N₂ 分子量: 162.23

IUPAC Name: 3-[(2S)-piperidin-2-yl]pyridine

SMILES: C1CCNC(C1)C2=CN=CC=C2

InChIKey: MTXSIJUGVMTTMU-JTQLQIEISA-N

InChI: InChI=1S/C10H14N2/c1-2-7-12-10(5-1)9-4-3-6-11-8-9/h3-4,6,8,10,12H,1-2,5,7H2/t10-/m0/s1
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二烯丙基三硫醚
- ≥65%
CAS号 : 2050-87-5 Compound CID : 16315

分子式: C₆H₁₀S₃ 分子量: 178.34

IUPAC Name: 3-(prop-2-enyltrisulfanyl)prop-1-ene

SMILES: C=CCSSSCC=C

InChIKey: UBAXRAHSPKWNCX-UHFFFAOYSA-N

InChI: InChI=1S/C6H10S3/c1-3-5-7-9-8-6-4-2/h3-4H,1-2,5-6H2
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富马酸亚铁
- ≥94%
CAS号 : 141-01-5 Compound CID : 6433164

分子式: C₄H₂FeO₄ 分子量: 169.9

IUPAC Name: (E)-but-2-enedioate;iron(2+)

SMILES: C(=CC(=O)[O-])C(=O)[O-].[Fe+2]

InChIKey: PMVSDNDAUGGCCE-TYYBGVCCSA-L

InChI: InChI=1S/C4H4O4.Fe/c5-3(6)1-2-4(7)8;/h1-2H,(H,5,6)(H,7,8);/q;+2/p-2/b2-1+;
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NF023,竞争性P2X 1受体拮抗剂
- ≥94%
CAS号 : 104869-31-0 Compound CID : 53249227

分子式: C₃₅H₂₀N₄Na₆O₂₁S₆·12·5H₂O 分子量: 1388.02

SMILES: C1=CC(=CC(=C1)NC(=O)NC2=CC=CC(=C2)C(=O)NC3=C4C(=CC(=CC4=C(C=C3)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)C(=O)NC5=C6C(=CC(=CC6=C(C=C5)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O.[Na].[Na].[Na].[Na].[Na].[Na]

InChIKey: GKOOKWDOKJAVBD-UHFFFAOYSA-N

InChI: InChI=1S/C35H26N4O21S6.6Na/c40-33(38-25-7-9-27(63(49,50)51)23-13-21(61(43,44)45)15-29(31(23)25)65(55,56)57)17-3-1-5-19(11-17)36-35(42)37-20-6-2-4-18(12-20)34(41)39-26-8-10-28(64(52,53)54)24-14-22(62(46,47)48)16-30(32(24)26)66(58,59)60;;;;;;/h1-16H,(H,38,40)(H,39,41)(H2,36,37,42)(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60);;;;;;
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NYC-488,新型钙蛋白酶抑制剂
- ≥94%
CAS号 : 1448429-06-8 Compound CID : 71660816

分子式: C₁₉H₁₇FN₆O₅S 分子量: 460.4

IUPAC Name: (2S,3S)-3-[[(2S)-1-[[1-(4-fluorophenyl)triazol-4-yl]methylamino]-1-oxo-3-(1,3-thiazol-4-yl)propan-2-yl]carbamoyl]oxirane-2-carboxylic acid

SMILES: C1=CC(=CC=C1N2C=C(N=N2)CNC(=O)C(CC3=CSC=N3)NC(=O)C4C(O4)C(=O)O)F

InChIKey: IPWMYOJQVHCYRC-JYJNAYRXSA-N

InChI: InChI=1S/C19H17FN6O5S/c20-10-1-3-13(4-2-10)26-7-12(24-25-26)6-21-17(27)14(5-11-8-32-9-22-11)23-18(28)15-16(31-15)19(29)30/h1-4,7-9,14-16H,5-6H2,(H,21,27)(H,23,28)(H,29,30)/t14-,15-,16-/m0/s1
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