6-Dehydrocortisol (8S,9S,10R,11S,13S,14S,17R)-11,17-二羟基-17-(2-羟基乙酰基)-10,13-二甲基-8,9,10,11,12,13,14,15,16,17-十氢-1H-环戊基[a]菲-3(2H)-酮 (氢化可的松杂质 )

CAS 600-99-7 MFCD00600997

化学结构图

600-99-7
SMILES: C[C@]12C[C@H](O)[C@H]3[C@@H](C=CC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)CO

化学属性

Mol. FormulaC21H28O5
Mol. Weight360.44
Melting Point239-241 °C
Boiling Point586.0±50.0 °C at 760 mmHg

别名和识别编码

Chemical Name Translation(8S,9S,10R,11S,13S,14S,17R)-11,17-二羟基-17-(2-羟基乙酰基)-10,13-二甲基-8,9,10,11,12,13,14,15,16,17-十氢-1H-环戊基[a]菲-3(2H)-酮 (氢化可的松杂质 )
PubChem Substance ID224450
InChIInChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h3-4,9,14-16,18,22,24,26H,5-8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1
CAS Number600-99-7
Synonym (8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-8,9,10,11,12,13,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3(2H)-one (Hydrocortisone Impurity) {LY} (8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-8,9,10,11,12,13,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3(2H)-one (Hydrocortisone Impurity) {} {LY} (8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-8,9,10,11,12,13,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3(2H)-one (Hydrocortisone Impurity) {} {} {LY} (8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-8,9,10,11,12,13,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3(2H)-one (Hydrocortisone Impurity) {} {} {} {LY} (8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-8,9,10,11,12,13,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3(2H)-one (Hydrocortisone Impurity) {} {} {} {} {LY} (8S,9S,10R,11S,13S,14S,
Canonical SMILESC[C@@]12[C@](CC[C@]2(O)C(CO)=O)([H])[C@@]3([H])[C@@]([C@H](C1)O)([H])[C@@]4(C(C=C3)=CC(CC4)=O)C
Chemical Name6-Dehydrocortisol
MDL NumberMFCD03695628
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安全信息

Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H341 Suspected of causing genetic defects 怀疑导致遗传性缺陷
Precautionary statements
  • P203
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西,喝水或吸烟。
  • P281 Use personal protective equipment as required. 使用所需的个人防护装备。
  • P301+P317
  • P318
  • P330 Rinse mouth. 漱口
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Storage condition

系列性分类


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