About: chenodeoxycholic acid 24-O-(beta-D-glucuronide)(1-)     Goto   Sponge   NotDistinct   Permalink

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anion

AttributesValues
rdf:type
description
  • anion (en)
  • аніон (uk)
rdfs:label
  • chenodeoxycholic acid 24-O-(beta-D-glucuronide)(1-) (en)
skos:prefLabel
  • chenodeoxycholic acid 24-O-(beta-D-glucuronide)(1-) (en)
name
  • chenodeoxycholic acid 24-O-(beta-D-glucuronide)(1-) (en)
isomeric SMILES
isomeric SMILES
  • C[C@H](CCC(=O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C(=O)[O-])O)O)O)[C@H]2CC[C@@H]3[C@@]2(CC[C@H]4[C@H]3[C@@H](C[C@H]5[C@@]4(CC[C@H](C5)O)C)O)C
instance of
instance of
subclass of
subclass of
UniChem compound ID
canonical SMILES
InChI
InChIKey
chemical formula
PubChem CID
ChEBI ID
PubChem CID
ChEBI ID
UniChem compound ID
  • 69957199
canonical SMILES
  • CC(CCC(=O)OC1OC(C(=O)[O-])C(O)C(O)C1O)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CCC12C
InChI
  • InChI=1S/C30H48O10/c1-14(4-7-21(33)39-28-25(36)23(34)24(35)26(40-28)27(37)38)17-5-6-18-22-19(9-11-30(17,18)3)29(2)10-8-16(31)12-15(29)13-20(22)32/h14-20,22-26,28,31-32,34-36H,4-13H2,1-3H3,(H,37,38)/p-1/t14-,15+,16-,17-,18+,19+,20-,22+,23+,24+,25-,26+,28-,29+,30-/m1/s1
InChIKey
  • ZTJBLIAPAIPNJE-BWGRGVIUSA-M
chemical formula
  • C₃₀H₄₇O₁₀⁻
PubChem CID
  • 71776683
ChEBI ID
  • 136899
mass
mass
is about of
is main subject of
is main subject of
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