Compound Search
化合物数据库
基于 PubChem CID 索引,支持名称 / 同义词 / CAS / SMILES 检索。
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(17a'*R,*E)-12'-hydroxy-2',17a'-dihydro-6'H-spiro[cyclopropane-1,9'-[3,4](epiprop[1]en[1]yl[3]ylidene PubChem CID 153561797
O=C1c2c(O)c(=O)ccn2N2CN1C1(/C=C/COc3cccc4c3[C@H]2c2ccccc2SC4)CC1 -
(17a'*R,*E)-24'-fluoro-12'-hydroxy-2',17a'-dihydro-6'H-spiro[cyclobutane-1,9'-[3,4](epiprop[1]en[1]yl PubChem CID 164607665
O=C1c2c(O)c(=O)ccn2N2CN1C1(/C=C/COc3cc(F)cc4c3[C@H]2c2ccccc2SC4)CCC1 -
(8R,9S,13S,14S)-3-((E)-1-(dimethyl(quinolin-8-yl)silyl)-2-(trimethylsilyl)vinyl)-13-methyl-6,7,8,9,11,12,13,14,15,16 PubChem CID 168265363
C.C[C@]12CC[C@@H]3c4ccc(/C(=C\[Si](C)(C)C)[Si](C)(C)c5cccc6cccnc56)cc4CC[C@H]3[C@@H]1CCC2=O -
(Z)-Docos-13-enoic acid, compound with 2,2',2''-nitrilotriethanol (1:1) CAS 84083-00-1 PubChem CID 44148436
CCCCCCCC/C=C\CCCCCCCCCCCC(=O)O.OCCN(CCO)CCO -
US9388136, Table 1, Compound 13:Ethyl N-(3- {4-[6-amino- 5-(4-fluoro- benzoyl)-2- oxopyridin- 1(2H)-yl PubChem CID 57658386
CCOC(=O)[C@H](CC(C)C)NCCCOc1cc(F)c(-n2c(N)c(C(=O)c3ccc(F)cc3)ccc2=O)c(F)c1 -
1-hydroxy-8-morpholino-tricyclo[6.5.0.02,7]trideca-2,4,6-triene-13- -spiro-(2'-1',3'-dioxan) (compound PubChem CID 139063132
O[C@]12c3ccccc3[C@@]1(N1CCOCC1)CCCCC21OCCCO1.O[C@]12c3ccccc3[C@@]1(N1CCOCC1)CCCCC21OCCCO1 -
(3R,5S)-1-((S)-2-(4-cyclopropyl-1H-1,2,3-triazol-1-yl)-3,3-dimethylbutanoyl)-5-(methylcarbamoyl)pyrrolidin PubChem CID 164607748
CNC(=O)[C@@H]1C[C@@H](OC(C)=O)CN1C(=O)[C@H](n1cc(C2CC2)nn1)C(C)(C)C -
D- gluconic acid, compound with N, N''- bis(4- chlorophenyl)- 3, 12- diimino- 2, 4, 11, 13- tetraazatetradecanediamidine CAS 18472-51-0 PubChem CID 60148207
NC(=NCCCCCCN=C(N)/N=C(\N)Nc1ccc(Cl)cc1)/N=C(\N)Nc1ccc(Cl)cc1.O=C(O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.S -
(18'*S,*E)-3',4'-difluoro-12'-hydroxy-18'-(3-methylpyridin-2-yl)-6'H,18'H-spiro[cyclobutane-1,9'-[10,17 PubChem CID 164607657
Cc1cccnc1[C@H]1c2ccc(F)c(F)c2OC/C=C/C2(CCC2)N2CN1n1ccc(=O)c(O)c1C2=O -
(18'*S,*E)-3',4'-difluoro-12'-hydroxy-18'-(pyridin-2-yl)-6'H,18'H-spiro[cyclobutane-1,9'-[10,17]methanobenzo PubChem CID 164607659
O=C1c2c(O)c(=O)ccn2N2CN1C1(/C=C/COc3c(ccc(F)c3F)[C@@H]2c2ccccn2)CCC1 -
Preparation of 6-((1-acetylpiperidin-4-yl)amino)-2-(benzo[d]oxazol-7-yl)pyrimidine-4-carboxylic acid PubChem CID 166070878
CC(=O)N1CCC(Nc2cc(C(=O)N3CC[C@@H](N4CCc5ccccc5C4)[C@H](O)C3)nc(-c3cccc4ncsc34)n2)CC1 -
Clc1ccc2c(c1)CCc1cccnc1C2=C1CCNCC1 -
(S)-9-Fluoro-2,3-dihydro-3-methyl-7-oxo-10-(1-piperazinyl)-7H-pyrido[1,2,3-de]-1,4-benzoxazine-6-carboxylic acid; DN 5455; Desmethyl Levofloxacin; UING 4-255; Levofloxacin Related Compound A (USP); Levofloxacin Related Compound A; Levofloxacin Hemihydrate Impurity B CAS 117707-40-1 PubChem CID 10958963
C[C@H]1COc2c(N3CCNCC3)c(F)cc3c(=O)c(C(=O)O)cn1c23 -
Loratadine Imp. G (EP); Loratadine USP Related Compound B; Loratadine USP RC B; 8-Chloro-11-(1-methylpiperidin-4-ylidene)-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine; Loratadine Related Compound B; Loratadine Impurity G CAS 38092-89-6 PubChem CID 31843
CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 -
C/C=C(\C)C(=O)N[C@@H](c1ccccc1)[C@@H](O)C(=O)O[C@H]1C[C@@]2(O)[C@@H](OC(=O)c3ccccc3)[C@@H]3[C@]4(OC(C)=O)CO[C@@H]4C[C@H](O)[C@@]3(C)C(=O)[C@H](OC(C)=O)C(=C1C)C2(C)C -
Loratadine Imp. B (EP); Loratadine USP Related Compound C; Loratadine USP RC C; 8-Chloro-5,6-dihydro-11H-benzo[5.6]cyclohepta[1,2-b]pyridin-11-one; Loratadine Related Compound C; Loratadine Impurity B CAS 31251-41-9 PubChem CID 9816260
O=C1c2ccc(Cl)cc2CCc2cccnc21 -
(4R,7S,10S,13R,16S,19R)-10-(4-aminobutyl)-19-[[(2R)-2-amino-3-phenyl-propanoyl]amino]-16-benzyl-7-[(1R)-1-hydroxyethyl]-N-[(1R,2R)-2-hydroxy-1-(hydroxymethyl)propyl]-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carboxamide CAS 83150-76-9 PubChem CID 448601
C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](N)Cc2ccccc2)CSSC[C@@H](C(=O)N[C@H](CO)[C@@H](C)O)NC1=O -
Ofloxacin Imp. E (EP); Ofloxacin USP Related Compound A; Ofloxacin USP RC A; (RS)-9-Fluoro-3-methyl-7-oxo-10-(piperazin-1-yl)-2,3-dihydro-7H-pyrido[1,2,3-de]-1,4-benzoxazine-6-carboxylic Acid; Ofloxacin Related Compound A; Ofloxacin Impurity E CAS 82419-52-1 PubChem CID 11725233
CC1COc2c(N3CCNCC3)c(F)cc3c(=O)c(C(=O)O)cn1c23 -
C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3C(=C)C[C@@]21CC -
(1R,2S)-1-(6-bromo-2-methoxyquinolin-3-yl)-4-(dimethylamino)-2-naphthalen-1-yl-1-phenylbutan-2-ol;13-hydroxy-12,14-dioxa-13lambda5-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaene 13-oxide CAS 916329-20-9 PubChem CID 131863385
COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12.O=P1(O)Oc2ccc3ccccc3c2-c2c(ccc3ccccc23)O1