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DL-异柠檬酸三钠盐 水合物分子式: C6H5O7Na3·xH2O 分子量: 258.07 (anhydrous basis)IUPAC Name: trisodium;1-hydroxypropane-1,2,3-tricarboxylateSMILES: C(C(C(C(=O)[O-])O)C(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+]InChIKey: HWMVXEKEEAIYGB-UHFFFAOYSA-KInChI: InChI=1S/C6H8O7.3Na/c7-3(8)1-2(5(10)11)4(9)6(12)13;;;/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13);;;/q;3*+1/p-3
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3-蒈烯CAS号 : 13466-78-9分子式: C10H16 分子量: 136.24IUPAC Name: 3,7,7-trimethylbicyclo[4.1.0]hept-3-eneSMILES: CC1=CCC2C(C1)C2(C)CInChIKey: BQOFWKZOCNGFEC-UHFFFAOYSA-NInChI: InChI=1S/C10H16/c1-7-4-5-8-9(6-7)10(8,2)3/h4,8-9H,5-6H2,1-3H3
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胆固醇壬酸酯分子式: C36H62O2 分子量: 526.89IUPAC Name: [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] nonanoateSMILES: CCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)CInChIKey: WCLNGBQPTVENHV-MKQVXYPISA-NInChI: InChI=1S/C36H62O2/c1-7-8-9-10-11-12-16-34(37)38-29-21-23-35(5)28(25-29)17-18-30-32-20-19-31(27(4)15-13-14-26(2)3)36(32,6)24-22-33(30)35/h17,26-27,29-33H,7-16,18-25H2,1-6H3/t27-,29+,30+,31-,32+,33+,35+,36-/m1/s1
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1,4-屈醌CAS号 : 100900-16-1分子式: C18H10O2 分子量: 258.28IUPAC Name: chrysene-1,4-dioneSMILES: C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3C(=O)C=CC4=OInChIKey: UORKIKBNUWJNJF-UHFFFAOYSA-NInChI: InChI=1S/C18H10O2/c19-16-9-10-17(20)18-14-6-5-11-3-1-2-4-12(11)13(14)7-8-15(16)18/h1-10H
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(+)-脱氢松香胺 [光学拆分剂]CAS号 : 1446-61-3分子式: C20H31N 分子量: 285.48IUPAC Name: [(1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl]methanamineSMILES: CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)CN)CInChIKey: JVVXZOOGOGPDRZ-SLFFLAALSA-NInChI: InChI=1S/C20H31N/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4/h6,8,12,14,18H,5,7,9-11,13,21H2,1-4H3/t18-,19-,20+/m0/s1
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植醇分子式: C20H40O 分子量: 296.54IUPAC Name: (E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-olSMILES: CC(C)CCCC(C)CCCC(C)CCCC(=CCO)CInChIKey: BOTWFXYSPFMFNR-PYDDKJGSSA-NInChI: InChI=1S/C20H40O/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-21/h15,17-19,21H,6-14,16H2,1-5H3/b20-15+/t18-,19-/m1/s1
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