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三辛酸甘油酯CAS号: 538-23-8分子式: C27H50O6 分子量: 470.69IUPAC Name: 2,3-di(octanoyloxy)propyl octanoateSMILES: CCCCCCCC(=O)OCC(COC(=O)CCCCCCC)OC(=O)CCCCCCCInChIKey: VLPFTAMPNXLGLX-UHFFFAOYSA-NInChI: 1S/C27H50O6/c1-4-7-10-13-16-19-25(28)31-22-24(33-27(30)21-18-15-12-9-6-3)23-32-26(29)20-17-14-11-8-5-2/h24H,4-23H2,1-3H3
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(+)-萜品-4-醇CAS号: 2438-10-0分子式: C10H18O 分子量: 154.25IUPAC Name: (1S)-4-methyl-1-propan-2-ylcyclohex-3-en-1-olSMILES: CC1=CCC(CC1)(C(C)C)OInChIKey: WRYLYDPHFGVWKC-SNVBAGLBSA-NInChI: 1S/C10H18O/c1-8(2)10(11)6-4-9(3)5-7-10/h4,8,11H,5-7H2,1-3H3/t10-/m1/s1
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4-吡哆酸-d3CAS号: 1435934-03-4 Compound CID : 117064439分子式: C8H6D3NO4 分子量: 186.18IUPAC Name: 3-hydroxy-5-(hydroxymethyl)-2-(trideuteriomethyl)pyridine-4-carboxylic acidSMILES: CC1=NC=C(C(=C1O)C(=O)O)COInChIKey: HXACOUQIXZGNBF-FIBGUPNXSA-NInChI: 1S/C8H9NO4/c1-4-7(11)6(8(12)13)5(3-10)2-9-4/h2,10-11H,3H2,1H3,(H,12,13)/i1D3
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D-葡萄糖-¹³C₆,1,2,3,4,5,6,6-d₇CAS号: 201417-01-8分子式: 13C6H5D7O6 分子量: 193.15IUPAC Name: (2R,3S,4R,5R)-1,2,3,4,5,6,6-heptadeuterio-2,3,4,5,6-pentahydroxy(1,2,3,4,5,6-13C6)hexan-1-oneSMILES: C(C(C(C(C(C=O)O)O)O)O)OInChIKey: GZCGUPFRVQAUEE-VVZLUFAVSA-NInChI: 1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h1,3-6,8-12H,2H2/t3-,4+,5+,6+/m0/s1/i1+1D,2+1D2,3+1D,4+1D,5+1D,6+1D
