Estriol-16alpha-(beta-D-glucuronide) 雌三醇16α-(β-D-葡萄糖醛酸)

CAS 1852-50-2 MFCD00056554

化学结构图

1852-50-2
SMILES: C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1C[C@H](OC1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O)[C@@H]2O

化学属性

Mol. FormulaC24H32O9
Mol. Weight464.51
Melting PointNo Data Available
Boiling Point

别名和识别编码

Chemical NameEstriol-16alpha-(beta-D-glucuronide)
Synonym 1,3,5(10)-Estratriene-3,16α,17β-triol 16-glucuronide 3,16α,17β-Trihydroxy-1,3,5(10)-estratriene 16-glucuronide 1,3,5(10)-Estratriene-3,16α,17β-triol 16-glucuronide 3,16α,17β-Trihydroxy-1,3,5(10)-estratriene 16-glucuronide Estriol 16-O-beta-D-Glucuronide {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
MDL NumberMFCD00056554
PubChem Substance ID122281
Beilstein Registry Number67674
CAS Number1852-50-2
Chemical Name Translation雌三醇16α-(β-D-葡萄糖醛酸)
InChIKeyFQYGGFDZJFIDPU-JRSYHJKYSA-N
InChIInChI=1S/C24H32O9/c1-24-7-6-13-12-5-3-11(25)8-10(12)2-4-14(13)15(24)9-16(21(24)29)32-23-19(28)17(26)18(27)20(33-23)22(30)31/h3,5,8,13-21,23,25-29H,2,4,6-7,9H2,1H3,(H,30,31)/t13-,14-,15+,16-,17+,18+,19-,20+,21+,23-,24+/m1/s1
Canonical SMILESC[C@@]12[C@](C[C@H]([C@@H]2O)O[C@@H]3O[C@@H]([C@H]([C@@H]([C@H]3O)O)O)C(O)=O)([H])[C@@]4([H])[C@@](CC1)([H])C5=CC=C(O)C=C5CC4
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分类

  • {SNA} Bioactive Small Molecule Alphabetical Index, Biochemicals and Reagents, Cytokines, Growth Factors and Hormones, E, Estrogen, Estrogens (C18) and Derivatives, Hormones, Lipids, Steroid Hormones, Sterol Lipids, 生物活性小分子, 细胞信号转导和神经科学, 细胞生物学
  • {SNA} Bioactive Small Molecules, Biochemicals and Reagents, Cell Biology, Cell Signaling and Neuroscience, Cytokines, Growth Factors and Hormones, E, Estrogen, Estrogens (C18) and Derivatives, Hormones, Lipids, Steroid Hormones, Sterol Lipids
  • {SNA} Bioactive Small Molecule Alphabetical Index,

相关文献及参考

  • Beil. 18 ,IV,5126

安全信息

WGK Germany3
GHS Symbol
Precautionary statements
  • P281 Use personal protective equipment as required. 使用所需的个人防护装备。
Hazard statements
  • H351 Suspected of causing cancer 怀疑致癌
Hazard Codes Xn
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Signal word Warning
Safety Statements
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
Risk Statements
  • R40 Limited evidence of a carcinogenic effect 有限证据表明其致癌作用
Storage condition N/A N/A℃ No Data Available

系列性分类

  1. Life Science 生命科学
  2. Biochemicals and Reagents 生化试剂
  3. Lipids - Biochemicals and Reagents
  4. Sterol Lipids - Lipids
  5. Estrogens (C18) and Derivatives - Sterol Lipids
  1. Life Science 生命科学
  2. Cell Biology 细胞生物学
  3. Cell Signaling and Neuroscience - Cell Biology
  4. Cytokines, Growth Factors and Hormones - Cell Signaling and Neuroscience
  5. Hormones - Cytokines, Growth Factors and Hormones
  6. Steroid Hormones - Hormones
  7. Estrogen - Steroid Hormones

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