化学生物学
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(R)-2-(Boc-氨基)-5-己炔酸CAS号 : 1217464-82-8 Compound CID : 71310729分子式: C11H17NO4 分子量: 227.26IUPAC Name: (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]hex-5-ynoic acidSMILES: CC(C)(C)OC(=O)NC(CCC#C)C(=O)OInChIKey: DPHIBCOGEUVKGB-MRVPVSSYSA-NInChI: InChI=1S/C11H17NO4/c1-5-6-7-8(9(13)14)12-10(15)16-11(2,3)4/h1,8H,6-7H2,2-4H3,(H,12,15)(H,13,14)/t8-/m1/s1
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钙黄绿素乙酰氧基甲酯CAS号 : 148504-34-1 Compound CID : 390986分子式: C46H46N2O23 分子量: 994.87IUPAC Name: acetyloxymethyl 2-[[2-(acetyloxymethoxy)-2-oxoethyl]-[[3',6'-diacetyloxy-7'-[[bis[2-(acetyloxymethoxy)-2-oxoethyl]amino]methyl]-3-oxospiro[2-benzofuran-1,9'-xanthene]-2'-yl]methyl]amino]acetateSMILES: CC(=O)OCOC(=O)CN(CC1=CC2=C(C=C1OC(=O)C)OC3=C(C24C5=CC=CC=C5C(=O)O4)C=C(C(=C3)OC(=O)C)CN(CC(=O)OCOC(=O)C)CC(=O)OCOC(=O)C)CC(=O)OCOC(=O)CInChIKey: BQRGNLJZBFXNCZ-UHFFFAOYSA-NInChI: InChI=1S/C46H46N2O23/c1-25(49)60-21-64-41(55)17-47(18-42(56)65-22-61-26(2)50)15-31-11-35-39(13-37(31)68-29(5)53)70-40-14-38(69-30(6)54)32(12-36(40)46(35)34-10-8-7-9-33(34)45(59)71-46)16-48(19-43(57)66-23-62-27(3)51)20-44(58)67-24-63-28(4)52/h7-14H,15-24H2,1-6H3
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罗丹2,细胞渗透性荧光Ca 2+指示剂CAS号 : 145037-81-6 Compound CID : 25229581分子式: C52H59BrN4O19 分子量: 1123.94IUPAC Name: [9-[4-[bis[2-(acetyloxymethoxy)-2-oxoethyl]amino]-3-[2-[2-[bis[2-(acetyloxymethoxy)-2-oxoethyl]amino]-5-methylphenoxy]ethoxy]phenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium;bromideSMILES: CC1=CC(=C(C=C1)N(CC(=O)OCOC(=O)C)CC(=O)OCOC(=O)C)OCCOC2=C(C=CC(=C2)C3=C4C=CC(=[N+](C)C)C=C4OC5=C3C=CC(=C5)N(C)C)N(CC(=O)OCOC(=O)C)CC(=O)OCOC(=O)C.[Br-]InChIKey: RWXWZOWDWYQKBK-UHFFFAOYSA-MInChI: InChI=1S/C52H59N4O19.BrH/c1-32-10-16-42(55(24-48(61)71-28-67-33(2)57)25-49(62)72-29-68-34(3)58)46(20-32)65-18-19-66-47-21-37(11-17-43(47)56(26-50(63)73-30-69-35(4)59)27-51(64)74-31-70-36(5)60)52-40-14-12-38(53(6)7)22-44(40)75-45-23-39(54(8)9)13-15-41(45)52;/h10-17,20-23H,18-19,24-31H2,1-9H3;1H/q+1;/p-1
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(R)-1-(2-吡啶)乙胺CAS号 : 45695-03-2 Compound CID : 1084918分子式: C7H10N2 分子量: 122.17IUPAC Name: (1R)-1-pyridin-2-ylethanamineSMILES: CC(C1=CC=CC=N1)NInChIKey: PDNHLCRMUIGNBV-ZCFIWIBFSA-NInChI: InChI=1S/C7H10N2/c1-6(8)7-4-2-3-5-9-7/h2-6H,8H2,1H3/t6-/m1/s1
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4,4'-氧双(苯磺酰肼)分子式: C12H14N4O5S2 分子量: 358.39IUPAC Name: 4-[4-(hydrazinesulfonyl)phenoxy]benzenesulfonohydrazideSMILES: C1=CC(=CC=C1OC2=CC=C(C=C2)S(=O)(=O)NN)S(=O)(=O)NNInChIKey: NBOCQTNZUPTTEI-UHFFFAOYSA-NInChI: InChI=1S/C12H14N4O5S2/c13-15-22(17,18)11-5-1-9(2-6-11)21-10-3-7-12(8-4-10)23(19,20)16-14/h1-8,15-16H,13-14H2
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( R )-α,α-双[3,5-双(三氟甲基)苯基] -2-吡咯烷甲醇叔丁基丁基二甲基甲硅烷基醚CAS号 : 1146629-74-4 Compound CID : 60203151分子式: C27H29F12NOSi 分子量: 639.59IUPAC Name: [bis[3,5-bis(trifluoromethyl)phenyl]-[(2R)-pyrrolidin-2-yl]methoxy]-tert-butyl-dimethylsilaneSMILES: CC(C)(C)[Si](C)(C)OC(C1CCCN1)(C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)FInChIKey: ZLULOCHUEDLXQY-OAQYLSRUSA-NInChI: InChI=1S/C27H29F12NOSi/c1-22(2,3)42(4,5)41-23(21-7-6-8-40-21,15-9-17(24(28,29)30)13-18(10-15)25(31,32)33)16-11-19(26(34,35)36)14-20(12-16)27(37,38)39/h9-14,21,40H,6-8H2,1-5H3/t21-/m1/s1
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Fmoc-谷氨酰胺(Dod)-OHCAS号 : 113534-17-1 Compound CID : 14561589分子式: C35H34N2O7 分子量: 594.65IUPAC Name: (2S)-5-[bis(4-methoxyphenyl)methylamino]-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxopentanoic acidSMILES: COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)NC(=O)CCC(C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35InChIKey: LATICJFEOIZOBM-HKBQPEDESA-NInChI: InChI=1S/C35H34N2O7/c1-42-24-15-11-22(12-16-24)33(23-13-17-25(43-2)18-14-23)37-32(38)20-19-31(34(39)40)36-35(41)44-21-30-28-9-5-3-7-26(28)27-8-4-6-10-29(27)30/h3-18,30-31,33H,19-21H2,1-2H3,(H,36,41)(H,37,38)(H,39,40)/t31-/m0/s1
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1-甲基-3-氧代-2-苯基哌嗪分子式: C11H14N2O 分子量: 190.24IUPAC Name: 4-methyl-3-phenylpiperazin-2-oneSMILES: CN1CCNC(=O)C1C2=CC=CC=C2InChIKey: KUVJOLVZDVEQGN-UHFFFAOYSA-NInChI: InChI=1S/C11H14N2O/c1-13-8-7-12-11(14)10(13)9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3,(H,12,14)
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乙烯基三丁酮肟基硅烷(异构体混合物)分子式: C14H27N3O3Si 分子量: 313.47IUPAC Name: N-[bis[(butan-2-ylideneamino)oxy]-ethenylsilyl]oxybutan-2-imineSMILES: CCC(=NO[Si](C=C)(ON=C(C)CC)ON=C(C)CC)CInChIKey: WXWYJCSIHQKADM-UHFFFAOYSA-NInChI: InChI=1S/C14H27N3O3Si/c1-8-12(5)15-18-21(11-4,19-16-13(6)9-2)20-17-14(7)10-3/h11H,4,8-10H2,1-3,5-7H3
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聚萘甲醛磺酸钠盐分子式: (C11H7O4SNa)nIUPAC Name: 5-[(6-sulfonaphthalen-1-yl)methyl]naphthalene-2-sulfonic acidSMILES: C1=CC2=C(C=CC(=C2)S(=O)(=O)O)C(=C1)CC3=CC=CC4=C3C=CC(=C4)S(=O)(=O)OInChIKey: XQFKOAKYKWUBKQ-UHFFFAOYSA-NInChI: InChI=1S/C21H16O6S2/c22-28(23,24)18-7-9-20-14(3-1-5-16(20)12-18)11-15-4-2-6-17-13-19(29(25,26)27)8-10-21(15)17/h1-10,12-13H,11H2,(H,22,23,24)(H,25,26,27)