按“信号通路”分类 - 小分子和化合物库 | 纯度: ≥65%, ≥95 atom% D,≥95%, ≥99 atom% 13C,≥98%

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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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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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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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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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