中文别名 | NB-598 Maleate(cas:155294-62-5) |
英文别名 | NB-598 Maleate,155294-62-5 |
CAS号 | 155294-62-5 |
SMILES | O=C(O)/C=C\C(O)=O.CC(C)(C)C#C/C=C/CN(CC)CC1=CC(OCC2=CC(C3=CSC=C3)=CS2)=CC=C1 |
Inchi | InChI=1S/C27H31NOS2.C4H4O4/c1-5-28(14-8-6-7-13-27(2,3)4)18-22-10-9-11-25(16-22)29-19-26-17-24(21-31-26)23-12-15-30-20-23;5-3(6)1-2-4(7)8/h6,8-12,15-17,20-21H,5,14,18-19H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b8-6+;2-1- |
InchiKey | QGUWPAYJKVJWEK-JVTXGDFZSA-N |
分子式 Formula | C31H35NO5S2 |
分子量 Molecular Weight | 565.74 |
溶解度Solubility | 生物体外In Vitro:DMSO溶解度100 mg/mL(176.76 mM;Need ultrasonic)H2O< 0.1 mg/mL(insoluble) |
性状 | Solid |
储藏条件 Storage conditions | 4℃, stored under nitrogen * In solvent溶液中 : -80℃, 6 months月; -20℃, 1 month月 (stored under nitrogen) |