N-[6-[(5,12-dihydroxy-10-methoxy-3,6,11-trioxo-2,4-dihydro-1H-tetracen-1-yl)oxy]-3-hydroxy-2-methyloxan-4-yl]-2,2,2-trifluoroacetamide
N-[6-[(5,12-dihydroxy-10-methoxy-3,6,11-trioxo-2,4-dihydro-1H-tetracen-1-yl)oxy]-3-hydroxy-2-methyloxan-4-yl]-2,2,2-trifluoroacetamide · CAS 64882-10-6
- 中文名
- 暂无
- 中文别名
- 暂无
- 英文名
- N-[6-[(5,12-dihydroxy-10-methoxy-3,6,11-trioxo-2,4-dihydro-1H-tetracen-1-yl)oxy]-3-hydroxy-2-methyloxan-4-yl]-2,2,2-trifluoroacetamide
- CAS
- 64882-10-6
- CID
- 319861
- IUPAC 名称
- N-[6-[(5,12-dihydroxy-10-methoxy-3,6,11-trioxo-2,4-dihydro-1H-tetracen-1-yl)oxy]-3-hydroxy-2-methyloxan-4-yl]-2,2,2-trifluoroacetamide
名称与编号
- 中文名
- 暂无
- 中文别名
- 暂无
- 英文名
- N-[6-[(5,12-dihydroxy-10-methoxy-3,6,11-trioxo-2,4-dihydro-1H-tetracen-1-yl)oxy]-3-hydroxy-2-methyloxan-4-yl]-2,2,2-trifluoroacetamide
- CAS
- 64882-10-6
- CID
- 319861
- IUPAC 名称
- N-[6-[(5,12-dihydroxy-10-methoxy-3,6,11-trioxo-2,4-dihydro-1H-tetracen-1-yl)oxy]-3-hydroxy-2-methyloxan-4-yl]-2,2,2-trifluoroacetamide
分子属性
- 分子式
- C27H24F3NO10
- 分子量
- 579.5 g/mol
- 精确质量
- 579.13523045 Da
- 单同位素质量
- 579.13523045 Da
- XLogP
- 3.3
- 极性表面积
- 169 Ų
- 氢键供体
- 4
- 氢键受体
- 13
- 可旋转键
- 4
- 重原子数
- 41
- 净电荷
- 0
- 结构复杂度
- 1070
结构标识
- InChIKey
- YUSOEVZUVPTPEG-UHFFFAOYSA-N
- SMILES
- CC1C(C(CC(O1)OC2CC(=O)CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)NC(=O)C(F)(F)F)O
- InChI
- InChI=1S/C27H24F3NO10/c1-9-21(33)13(31-26(38)27(28,29)30)8-16(40-9)41-15-7-10(32)6-12-18(15)25(37)20-19(23(12)35)22(34)11-4-3-5-14(39-2)17(11)24(20)36/h3-5,9,13,15-16,21,33,35,37H,6-8H2,1-2H3,(H,31,38)