小分子和化合物库
选项
-
API-1,Akt / PKB抑制剂CAS号: 36707-00-3分子式: C13H15N5O6 分子量: 337.29IUPAC Name: 4-amino-8-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-oxopyrido[2,3-d]pyrimidine-6-carboxamideSMILES: C1=C(C(=O)C2=C(N=CN=C2N1C3C(C(C(O3)CO)O)O)N)C(=O)NInChIKey: SPBWHPXCWJLQRU-FITJORAGSA-NInChI: 1S/C13H15N5O6/c14-10-6-7(20)4(11(15)23)1-18(12(6)17-3-16-10)13-9(22)8(21)5(2-19)24-13/h1,3,5,8-9,13,19,21-22H,2H2,(H2,15,23)(H2,14,16,17)/t5-,8-,9-,13-/m1/s1
-
美伐他汀CAS号: 73573-88-3分子式: C23H34O5 分子量: 390.51IUPAC Name: [(1S,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-7-methyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] (2S)-2-methylbutanoateSMILES: CCC(C)C(=O)OC1CCC=C2C1C(C(C=C2)C)CCC3CC(CC(=O)O3)OInChIKey: AJLFOPYRIVGYMJ-INTXDZFKSA-NInChI: 1S/C23H34O5/c1-4-14(2)23(26)28-20-7-5-6-16-9-8-15(3)19(22(16)20)11-10-18-12-17(24)13-21(25)27-18/h6,8-9,14-15,17-20,22,24H,4-5,7,10-13H2,1-3H3/t14-,15-,17+,18+,19-,20-,22-/m0/s1
-
β-胡萝卜素分子式: C40H56 分子量: 536.87IUPAC Name: 1,3,3-trimethyl-2-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethylcyclohexen-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohexeneSMILES: CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC2=C(CCCC2(C)C)C)C)CInChIKey: OENHQHLEOONYIE-JLTXGRSLSA-NInChI: See more
-
-
-
生物素-PEG₄-叠氮CAS号: 1309649-57-7分子式: C20H36N6O6S 分子量: 488.6IUPAC Name: 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethyl]pentanamideSMILES: C1C2C(C(S1)CCCCC(=O)NCCOCCOCCOCCOCCN=[N+]=[N-])NC(=O)N2InChIKey: PVEHVEYAPUNCCP-LNLFQRSKSA-NInChI: 1S/C20H36N6O6S/c21-26-23-6-8-30-10-12-32-14-13-31-11-9-29-7-5-22-18(27)4-2-1-3-17-19-16(15-33-17)24-20(28)25-19/h16-17,19H,1-15H2,(H,22,27)(H2,24,25,28)/t16-,17-,19-/m0/s1
-
-
异丹叶大黄素CAS号: 32507-66-7分子式: C15H14O4 分子量: 258.27IUPAC Name: 5-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]benzene-1,3-diolSMILES: COC1=C(C=CC(=C1)C=CC2=CC(=CC(=C2)O)O)OInChIKey: ANNNBEZJTNCXHY-NSCUHMNNSA-NInChI: 1S/C15H14O4/c1-19-15-8-10(4-5-14(15)18)2-3-11-6-12(16)9-13(17)7-11/h2-9,16-18H,1H3/b3-2+
-
利诺安CAS号: 84088-42-6分子式: C18H16N2O3 分子量: 308.34IUPAC Name: 4-hydroxy-N,1-dimethyl-2-oxo-N-phenylquinoline-3-carboxamideSMILES: CN1C2=CC=CC=C2C(=C(C1=O)C(=O)N(C)C3=CC=CC=C3)OInChIKey: SGOOQMRIPALTEL-UHFFFAOYSA-NInChI: 1S/C18H16N2O3/c1-19(12-8-4-3-5-9-12)17(22)15-16(21)13-10-6-7-11-14(13)20(2)18(15)23/h3-11,21H,1-2H3
-
醋酸孕甾酮CAS号: 595-33-5分子式: C24H32O4 分子量: 384.52IUPAC Name: [(8R,9S,10R,13S,14S,17R)-17-acetyl-6,10,13-trimethyl-3-oxo-2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-17-yl] acetateSMILES: CC1=CC2C(CCC3(C2CCC3(C(=O)C)OC(=O)C)C)C4(C1=CC(=O)CC4)CInChIKey: RQZAXGRLVPAYTJ-GQFGMJRRSA-NInChI: 1S/C24H32O4/c1-14-12-18-19(22(4)9-6-17(27)13-21(14)22)7-10-23(5)20(18)8-11-24(23,15(2)25)28-16(3)26/h12-13,18-20H,6-11H2,1-5H3/t18-,19+,20+,22-,23+,24+/m1/s1
-
模绕酮酸CAS号: 6713-27-5分子式: C30H46O3 分子量: 454.7IUPAC Name: (4aS,6aR,6aR,6bR,8aR,12aR,14aS)-2,2,6a,6b,9,9,12a-heptamethyl-10-oxo-4,5,6,6a,7,8,8a,11,12,13,14,14a-dodecahydro-3H-picene-4a-carboxylic acidSMILES: CC1(CCC2(CCC3(C(C2=C1)CCC4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C)C(=O)O)CInChIKey: UMYJVVZWBKIXQQ-QALSDZMNSA-NInChI: 1S/C30H46O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h18-19,21-22H,8-17H2,1-7H3,(H,32,33)/t19-,21+,22-,27+,28-,29-,30+/m1/s1
-
N-羟基-3-[1-(苯基硫代)甲基-1H-1,2,3-三氮唑-4-基]苯甲酰胺CAS号: 1316652-41-1分子式: C16H14N4O2S 分子量: 326.37IUPAC Name: N-hydroxy-3-[1-(phenylsulfanylmethyl)triazol-4-yl]benzamideSMILES: C1=CC=C(C=C1)SCN2C=C(N=N2)C3=CC(=CC=C3)C(=O)NOInChIKey: DORPIZJGSLWDIY-UHFFFAOYSA-NInChI: 1S/C16H14N4O2S/c21-16(18-22)13-6-4-5-12(9-13)15-10-20(19-17-15)11-23-14-7-2-1-3-8-14/h1-10,22H,11H2,(H,18,21)
首页
400-620-6333











![N-羟基-3-[1-(苯基硫代)甲基-1H-1,2,3-三氮唑-4-基]苯甲酰胺](https://mgt-cn248-dev.env.aladdin-e.com/media/catalog/product/cache/376550291f0b07c370a96cc20f301bc2/N/1/N159732.png)