小分子和化合物库
选项
-
L-[1-13C]葡萄糖CAS号: 478519-02-7分子式: C513CH12O6 分子量: 181.15IUPAC Name: (3S,4R,5R,6S)-6-(hydroxymethyl)(213C)oxane-2,3,4,5-tetrolSMILES: C(C1C(C(C(C(O1)O)O)O)O)OInChIKey: WQZGKKKJIJFFOK-WIZIAPGRSA-NInChI: 1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6?/m0/s1/i6+1
-
乙酰胆碱-d9氯化物CAS号: 344298-95-9分子式: C7H7D9ClNO2 分子量: 190.72IUPAC Name: 2-acetyloxyethyl-tris(trideuteriomethyl)azanium;chlorideSMILES: CC(=O)OCC[N+](C)(C)C.[Cl-]InChIKey: JUGOREOARAHOCO-WWMMTMLWSA-MInChI: 1S/C7H16NO2.ClH/c1-7(9)10-6-5-8(2,3)4;/h5-6H2,1-4H3;1H/q+1;/p-1/i2D3,3D3,4D3;
-
富马酸13C4CAS号: 201595-62-2分子式: 13C4H4O4 分子量: 120.04IUPAC Name: (E)-(1,2,3,4-13C4)but-2-enedioic acidSMILES: C(=CC(=O)O)C(=O)OInChIKey: VZCYOOQTPOCHFL-BHBLSLFXSA-NInChI: 1S/C4H4O4/c5-3(6)1-2-4(7)8/h1-2H,(H,5,6)(H,7,8)/b2-1+/i1+1,2+1,3+1,4+1
-
L-谷氨酸-15NCAS号: 21160-87-2分子式: C5H815NO4 分子量: 148.12IUPAC Name: (2S)-2-(15N)azanylpentanedioic acidSMILES: C(CC(=O)O)C(C(=O)O)NInChIKey: WHUUTDBJXJRKMK-OGWWSMAPSA-NInChI: 1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1/i6+1
-
L-亮氨酸-15NCAS号: 59935-31-8分子式: C6H1215NO2 分子量: 132.17IUPAC Name: (2S)-2-(15N)azanyl-4-methylpentanoic acidSMILES: CC(C)CC(C(=O)O)NInChIKey: ROHFNLRQFUQHCH-GEERXGHESA-NInChI: 1S/C6H13NO2/c1-4(2)3-5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t5-/m0/s1/i7+1
-
1,7-二甲基黄嘌呤-2,4,5,6-¹³C₄-1,3,9-¹⁵N₃CAS号: 1173018-79-5分子式: C313C4H8N¹⁵N3O2 分子量: 187.12IUPAC Name: 1,7-dimethyl-3H-purine-2,6-dioneSMILES: CN1C=NC2=C1C(=O)N(C(=O)N2)CInChIKey: QUNWUDVFRNGTCO-UDYOVZSYSA-NInChI: 1S/C7H8N4O2/c1-10-3-8-5-4(10)6(12)11(2)7(13)9-5/h3H,1-2H3,(H,9,13)/i4+1,5+1,6+1,7+1,8+1,9+1,11+1
-
1,7-二苯基-4-庚烯-3-oneCAS号: 79559-59-4分子式: C19H20O 分子量: 264.36IUPAC Name: (E)-1,7-diphenylhept-4-en-3-oneSMILES: C1=CC=C(C=C1)CCC=CC(=O)CCC2=CC=CC=C2InChIKey: UDNMYDZHPMNIEQ-RIYZIHGNSA-NInChI: 1S/C19H20O/c20-19(16-15-18-11-5-2-6-12-18)14-8-7-13-17-9-3-1-4-10-17/h1-6,8-12,14H,7,13,15-16H2/b14-8+
-
1-(3-乙基-2,4-二羟基-6-甲氧基苯基)-1-丁酮CAS号: 159686-24-5分子式: C13H18O4 分子量: 238.28IUPAC Name: 1-(3-ethyl-2,4-dihydroxy-6-methoxyphenyl)butan-1-oneSMILES: CCCC(=O)C1=C(C=C(C(=C1O)CC)O)OCInChIKey: GRQAKVFPDMDUIF-UHFFFAOYSA-NInChI: 1S/C13H18O4/c1-4-6-9(14)12-11(17-3)7-10(15)8(5-2)13(12)16/h7,15-16H,4-6H2,1-3H3
-
1-甲基黄嘌呤-2,4,5,6-¹³C₄, 1,3,9-¹⁵N₃CAS号: 1173018-69-3分子式: C6H6N4O2 分子量: 173.09IUPAC Name: 1-methyl-3,7-dihydropurine-2,6-dioneSMILES: CN1C(=O)C2=C(NC1=O)N=CN2InChIKey: MVOYJPOZRLFTCP-UDDVCBLJSA-NInChI: 1S/C6H6N4O2/c1-10-5(11)3-4(8-2-7-3)9-6(10)12/h2H,1H3,(H,7,8)(H,9,12)/i3+1,4+1,5+1,6+1,8+1,9+1,10+1
-
2,4-二氯酯酸甲酯CAS号: 398118-62-2分子式: C18H16Cl2O8 分子量: 431.22IUPAC Name: methyl 3,5-dichloro-2-hydroxy-6-(4-hydroxy-2-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoateSMILES: CC1=C(C(=C(C(=C1Cl)OC2=C(C=C(C=C2OC)O)C(=O)OC)C(=O)OC)O)ClInChIKey: UWTOESDPWKUNBD-UHFFFAOYSA-NInChI: 1S/C18H16Cl2O8/c1-7-12(19)14(22)11(18(24)27-4)16(13(7)20)28-15-9(17(23)26-3)5-8(21)6-10(15)25-2/h5-6,21-22H,1-4H3
-
2-(2-乙酰基-3-羟基-5-甲氧基苯基)乙酸CAS号: 19054-28-5分子式: C11H12O5 分子量: 224.21IUPAC Name: 2-(2-acetyl-3-hydroxy-5-methoxyphenyl)acetic acidSMILES: CC(=O)C1=C(C=C(C=C1O)OC)CC(=O)OInChIKey: UYUOIPIOTPMHKV-UHFFFAOYSA-NInChI: 1S/C11H12O5/c1-6(12)11-7(4-10(14)15)3-8(16-2)5-9(11)13/h3,5,13H,4H2,1-2H3,(H,14,15)
-
2-甲氧基-¹³C,d₃-雌酮CAS号: 1217460-84-8分子式: C19H24O3 分子量: 301.4IUPAC Name: (8R,9S,13S,14S)-3-hydroxy-2-(113C)methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-oneSMILES: CC12CCC3C(C1CCC2=O)CCC4=CC(=C(C=C34)OC)OInChIKey: WHEUWNKSCXYKBU-IQEHBMMRSA-NInChI: 1S/C19H24O3/c1-19-8-7-12-13(15(19)5-6-18(19)21)4-3-11-9-16(20)17(22-2)10-14(11)12/h9-10,12-13,15,20H,3-8H2,1-2H3/t12-,13+,15-,19-/m0/s1/i2+1
首页
400-620-6333
![L-[1-13C]葡萄糖](https://mgt-cn248-dev.env.aladdin-e.com/media/catalog/product/cache/376550291f0b07c370a96cc20f301bc2/L/3/L354520.png)










