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双氰异烟胺CAS号: 27792-36-5 Compound CID : 6450878分子式: C50H72CoN13O8 分子量: 1042.12IUPAC Name: See more
SMILES: CC1=C2C(C(C([N-]2)C3(C(C(C(=N3)C(=C4C(C(C(=N4)C=C5C(C(C1=N5)CCC(=O)N)(C)C)CCC(=O)N)(C)CC(=O)N)C)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)(C)CCC(=O)NCC(C)O.[C-]#N.[C-]#N.[Co]InChIKey: NWXVHVXSDZHCFS-TWXWJCICSA-MInChI: See more -
四乙酰基-α-D-溴代半乳糖CAS号: 3068-32-4分子式: C14H19BrO9 分子量: 411.2IUPAC Name: [(2R,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-bromooxan-2-yl]methyl acetateSMILES: CC(=O)OCC1C(C(C(C(O1)Br)OC(=O)C)OC(=O)C)OC(=O)CInChIKey: CYAYKKUWALRRPA-HTOAHKCRSA-NInChI: 1S/C14H19BrO9/c1-6(16)20-5-10-11(21-7(2)17)12(22-8(3)18)13(14(15)24-10)23-9(4)19/h10-14H,5H2,1-4H3/t10-,11+,12+,13-,14+/m1/s1
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乙酰溴-α-D-葡萄糖醛酸甲酯CAS号: 21085-72-3 EC号: 244-203-4分子式: C13H17BrO9 分子量: 397.17IUPAC Name: methyl (2S,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-bromooxane-2-carboxylateSMILES: CC(=O)OC1C(C(OC(C1OC(=O)C)Br)C(=O)OC)OC(=O)CInChIKey: GWTNLHGTLIBHHZ-SVNGYHJRSA-NInChI: 1S/C13H17BrO9/c1-5(15)20-8-9(21-6(2)16)11(13(18)19-4)23-12(14)10(8)22-7(3)17/h8-12H,1-4H3/t8-,9-,10+,11-,12-/m0/s1
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核黄素磷酸钠分子式: C17H20N4NaO9P 分子量: 478.33IUPAC Name: sodium;[(2R,3S,4S)-5-(7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)-2,3,4-trihydroxypentyl] hydrogen phosphateSMILES: CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)CC(C(C(COP(=O)(O)[O-])O)O)O.[Na+]InChIKey: OHSHFZJLPYLRIP-BMZHGHOISA-MInChI: 1S/C17H21N4O9P.Na/c1-7-3-9-10(4-8(7)2)21(15-13(18-9)16(25)20-17(26)19-15)5-11(22)14(24)12(23)6-30-31(27,28)29;/h3-4,11-12,14,22-24H,5-6H2,1-2H3,(H,20,25,26)(H2,27,28,29);/q;+1/p-1/t11-,12+,14-;/m0./s1
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胆固醇壬酸酯CAS号: 1182-66-7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: See more
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甲基3,4,6-三-O-乙酰-2-脱氧-2-邻苯二甲酰亚氨基-1-硫代-β-D-吡喃葡萄糖苷CAS号: 79528-48-6 Compound CID : 13991662分子式: C21H23NO9S 分子量: 465.47IUPAC Name: [(2R,3S,4R,5R,6S)-3,4-diacetyloxy-5-(1,3-dioxoisoindol-2-yl)-6-methylsulfanyloxan-2-yl]methyl acetateSMILES: CC(=O)OCC1C(C(C(C(O1)SC)N2C(=O)C3=CC=CC=C3C2=O)OC(=O)C)OC(=O)CInChIKey: QNHCRERIIKDXAI-PLQGUWCTSA-NInChI: 1S/C21H23NO9S/c1-10(23)28-9-15-17(29-11(2)24)18(30-12(3)25)16(21(31-15)32-4)22-19(26)13-7-5-6-8-14(13)20(22)27/h5-8,15-18,21H,9H2,1-4H3/t15-,16-,17-,18-,21+/m1/s1
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Nα-[(9H-芴-9-基甲氧基)羰基]-L-苏氨酸叔丁酯CAS号: 120791-76-6 Compound CID : 11773868分子式: C23H27NO5 分子量: 397.47IUPAC Name: tert-butyl (2S,3R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-hydroxybutanoateSMILES: CC(C(C(=O)OC(C)(C)C)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)OInChIKey: LMRQPSBMLDCJGN-VLIAUNLRSA-NInChI: 1S/C23H27NO5/c1-14(25)20(21(26)29-23(2,3)4)24-22(27)28-13-19-17-11-7-5-9-15(17)16-10-6-8-12-18(16)19/h5-12,14,19-20,25H,13H2,1-4H3,(H,24,27)/t14-,20+/m1/s1
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N-苄氧羰基-S-苯基-L-半胱氨酸CAS号: 159453-24-4分子式: C17H17NO4S 分子量: 331.39IUPAC Name: (2R)-2-(phenylmethoxycarbonylamino)-3-phenylsulfanylpropanoic acidSMILES: C1=CC=C(C=C1)COC(=O)NC(CSC2=CC=CC=C2)C(=O)OInChIKey: ISBOGFMUFMJWEP-HNNXBMFYSA-NInChI: 1S/C17H17NO4S/c19-16(20)15(12-23-14-9-5-2-6-10-14)18-17(21)22-11-13-7-3-1-4-8-13/h1-10,15H,11-12H2,(H,18,21)(H,19,20)/t15-/m0/s1
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苯基硫代乙内酰脲-蛋氨酸分子式: C12H14N2OS2 分子量: 266.38IUPAC Name: 5-(2-methylsulfanylethyl)-3-phenyl-2-sulfanylideneimidazolidin-4-oneSMILES: CSCCC1C(=O)N(C(=S)N1)C2=CC=CC=C2InChIKey: KALSXWPXUWRLOH-UHFFFAOYSA-NInChI: 1S/C12H14N2OS2/c1-17-8-7-10-11(15)14(12(16)13-10)9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3,(H,13,16)
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苯基3,4,6-三-O-乙酰基-2-脱氧-1-硫代-2-(2,2,2-三氯乙氧基甲酰氨基)-β-D-吡喃半乳糖苷CAS号: 278784-83-1 Compound CID : 10674621分子式: C21H24Cl3NO9S 分子量: 572.83IUPAC Name: [(2R,3R,4R,5R,6S)-3,4-diacetyloxy-6-phenylsulfanyl-5-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]methyl acetateSMILES: CC(=O)OCC1C(C(C(C(O1)SC2=CC=CC=C2)NC(=O)OCC(Cl)(Cl)Cl)OC(=O)C)OC(=O)CInChIKey: AZDNCEYOFMNMSH-FQBWVUSXSA-NInChI: 1S/C21H24Cl3NO9S/c1-11(26)30-9-15-17(32-12(2)27)18(33-13(3)28)16(25-20(29)31-10-21(22,23)24)19(34-15)35-14-7-5-4-6-8-14/h4-8,15-19H,9-10H2,1-3H3,(H,25,29)/t15-,16-,17+,18-,19+/m1/s1
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甲氯芬那酸钠分子式: C14H10Cl2NNaO2 分子量: 318.13IUPAC Name: sodium;2-(2,6-dichloro-3-methylanilino)benzoateSMILES: CC1=C(C(=C(C=C1)Cl)NC2=CC=CC=C2C(=O)[O-])Cl.[Na+]InChIKey: OGPIIGMUPMPMNT-UHFFFAOYSA-MInChI: 1S/C14H11Cl2NO2.Na/c1-8-6-7-10(15)13(12(8)16)17-11-5-3-2-4-9(11)14(18)19;/h2-7,17H,1H3,(H,18,19);/q;+1/p-1
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D-葡萄糖胺肟盐酸盐CAS号: 54947-34-1 Compound CID : 77519621分子式: C6H14N2O5·HCl 分子量: 230.65IUPAC Name: (2R,3S,4R,5S,6E)-5-amino-6-hydroxyiminohexane-1,2,3,4-tetrol;hydrochlorideSMILES: C(C(C(C(C(C=NO)N)O)O)O)O.ClInChIKey: FBSKNFHFTDIXRN-XGFKIDBYSA-NInChI: 1S/C6H14N2O5.ClH/c7-3(1-8-13)5(11)6(12)4(10)2-9;/h1,3-6,9-13H,2,7H2;1H/b8-1+;/t3-,4+,5+,6+;/m0./s1
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