Chemical Compound

bilirubin diglucuronide

CAS Registry Number 17459-92-6
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bilirubin diglucuronide chemical structure
Primary Record

bilirubin diglucuronide

In stock
1,736 g
Purity
98.8 %
CAS
17459-92-6

Compound Identifiers & Properties

CAS
17459-92-6
PubChem CID
71776465
SMILES
CC1=C(NC(=C1CCC(=O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O)CC3=C(C(=C(N3)/C=C/4\C(=C(C(=O)N4)C)C=C)C)CCC(=O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O)/C=C\6/C(=C(C(=O)N6)C=C)C
Canonical SMILES
C=CC1=C(C)/C(=C/c2[nH]c(Cc3[nH]c(/C=C4/NC(=O)C(C)=C4C=C)c(C)c3CCC(=O)O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)c(CCC(=O)O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)c2C)NC1=O

Names & Synonyms

  • bilirubin diglucuronide
  • C45H52N4O18
  • C45-H52-N4-O18
  • 17459-92-6