Chemical Compound

NIOSH/FZ2220000

NIOSH/FZ2220000 chemical structure
Primary Record

NIOSH/FZ2220000

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
145453251
SMILES
C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](CC3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C.C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](CC3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C.C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](CC3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C.C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](CC3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C.C1C=CCC2=C1C=CC3=CC4=C(C=CC5=CC=CC=C54)C=C23
Canonical SMILES
C1=CCc2c(ccc3cc4c(ccc5ccccc54)cc23)C1.C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)C3C[C@H](O)[C@]12C.C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)C3C[C@H](O)[C@]12C.C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)C3C[C@H](O)[C@]12C.C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)C3C[C@H](O)[C@]12C

Names & Synonyms

  • NIOSH/FZ2220000
  • 1,2,5,6-Dibenzanthracene-choleic acid
  • FZ22200000
  • 5-beta-Cholan-24-oic acid, 3-alpha-12-alpha-dihydroxy-, compound with dibenz(a,h)anthracene