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原花青素B2CAS号 : 29106-49-8 Compound CID : 122738分子式: C30H26O12 分子量: 578.52IUPAC Name: (2R,3R)-2-(3,4-dihydroxyphenyl)-8-[(2R,3R,4R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triolSMILES: C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)OInChIKey: XFZJEEAOWLFHDH-NFJBMHMQSA-NInChI: InChI=1S/C30H26O12/c31-13-7-20(37)24-23(8-13)41-29(12-2-4-16(33)19(36)6-12)27(40)26(24)25-21(38)10-17(34)14-9-22(39)28(42-30(14)25)11-1-3-15(32)18(35)5-11/h1-8,10,22,26-29,31-40H,9H2/t22-,26-,27-,28-,29-/m1/s1
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(+)-δ-生育酚分子式: C27H46O2 分子量: 402.65IUPAC Name: (2R)-2,8-dimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-olSMILES: CC1=CC(=CC2=C1OC(CC2)(C)CCCC(C)CCCC(C)CCCC(C)C)OInChIKey: GZIFEOYASATJEH-VHFRWLAGSA-NInChI: InChI=1S/C27H46O2/c1-20(2)10-7-11-21(3)12-8-13-22(4)14-9-16-27(6)17-15-24-19-25(28)18-23(5)26(24)29-27/h18-22,28H,7-17H2,1-6H3/t21-,22-,27-/m1/s1
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磷酸二鲸蜡酯分子式: C32H67O4P 分子量: 546.85IUPAC Name: dihexadecyl hydrogen phosphateSMILES: CCCCCCCCCCCCCCCCOP(=O)(O)OCCCCCCCCCCCCCCCCInChIKey: RNPXCFINMKSQPQ-UHFFFAOYSA-NInChI: InChI=1S/C32H67O4P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35-37(33,34)36-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-32H2,1-2H3,(H,33,34)
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二氢辣椒碱CAS号 : 19408-84-5 Compound CID : 107982分子式: C18H29NO3 分子量: 307.43IUPAC Name: N-[(4-hydroxy-3-methoxyphenyl)methyl]-8-methylnonanamideSMILES: CC(C)CCCCCCC(=O)NCC1=CC(=C(C=C1)O)OCInChIKey: XJQPQKLURWNAAH-UHFFFAOYSA-NInChI: InChI=1S/C18H29NO3/c1-14(2)8-6-4-5-7-9-18(21)19-13-15-10-11-16(20)17(12-15)22-3/h10-12,14,20H,4-9,13H2,1-3H3,(H,19,21)
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2',7'-二氯荧光素分子式: C20H10Cl2O5 分子量: 401.2IUPAC Name: 2',7'-dichloro-3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-oneSMILES: C1=CC=C2C(=C1)C(=O)OC23C4=CC(=C(C=C4OC5=CC(=C(C=C35)Cl)O)O)ClInChIKey: VFNKZQNIXUFLBC-UHFFFAOYSA-NInChI: InChI=1S/C20H10Cl2O5/c21-13-5-11-17(7-15(13)23)26-18-8-16(24)14(22)6-12(18)20(11)10-4-2-1-3-9(10)19(25)27-20/h1-8,23-24H
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2-乙基己基二苯基磷酸酯分子式: C20H27O4P 分子量: 362.4IUPAC Name: 2-ethylhexyl diphenyl phosphateSMILES: CCCCC(CC)COP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2InChIKey: CGSLYBDCEGBZCG-UHFFFAOYSA-NInChI: InChI=1S/C20H27O4P/c1-3-5-12-18(4-2)17-22-25(21,23-19-13-8-6-9-14-19)24-20-15-10-7-11-16-20/h6-11,13-16,18H,3-5,12,17H2,1-2H3
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5’-二磷酸鸟苷二钠分子式: C10H13N5O11P2Na2 分子量: 487.17IUPAC Name: disodium;[[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] hydrogen phosphateSMILES: C1=NC2=C(N1C3C(C(C(O3)COP(=O)([O-])OP(=O)(O)[O-])O)O)N=C(NC2=O)N.[Na+].[Na+]InChIKey: LTZCGDIGAHOTKN-LGVAUZIVSA-LInChI: InChI=1S/C10H15N5O11P2.2Na/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(25-9)1-24-28(22,23)26-27(19,20)21;;/h2-3,5-6,9,16-17H,1H2,(H,22,23)(H2,19,20,21)(H3,11,13,14,18);;/q;2*+1/p-2/t3-,5-,6-,9-;;/m1../s1
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谷胱甘肽乙基酯CAS号 : 92614-59-0 Compound CID : 147253分子式: C12H21N3O6S 分子量: 335.38IUPAC Name: (2S)-2-amino-5-[[(2R)-1-[(2-ethoxy-2-oxoethyl)amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-5-oxopentanoic acidSMILES: CCOC(=O)CNC(=O)C(CS)NC(=O)CCC(C(=O)O)NInChIKey: JKRODHBGNBKZLE-YUMQZZPRSA-NInChI: InChI=1S/C12H21N3O6S/c1-2-21-10(17)5-14-11(18)8(6-22)15-9(16)4-3-7(13)12(19)20/h7-8,22H,2-6,13H2,1H3,(H,14,18)(H,15,16)(H,19,20)/t7-,8-/m0/s1
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鸟苷-5'-三磷酸二钠盐CAS号 : 56001-37-7 Compound CID : 135465086分子式: C10H14N5Na2O14P3 分子量: 567.15IUPAC Name: disodium;[[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] phosphono phosphateSMILES: C1=NC2=C(N1C3C(C(C(O3)COP(=O)([O-])OP(=O)([O-])OP(=O)(O)O)O)O)N=C(NC2=O)N.[Na+].[Na+]InChIKey: FIZIYLKEXVIRHJ-LGVAUZIVSA-LInChI: InChI=1S/C10H16N5O14P3.2Na/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(27-9)1-26-31(22,23)29-32(24,25)28-30(19,20)21;;/h2-3,5-6,9,16-17H,1H2,(H,22,23)(H,24,25)(H2,19,20,21)(H3,11,13,14,18);;/q;2*+1/p-2/t3-,5-,6-,9-;;/m1../s1
