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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > ion > anion > organic anion > organosulfate oxoanion > steroid sulfate oxoanion > chenodeoxycholate 7-sulfate(2-)
... > chemical entity > molecular entity > ion > organic ion > organic anion > organosulfate oxoanion > steroid sulfate oxoanion > chenodeoxycholate 7-sulfate(2-)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic ion > organic anion > organosulfate oxoanion > steroid sulfate oxoanion > chenodeoxycholate 7-sulfate(2-)
... > chemical entity > molecular entity > ion > anion > polyatomic anion > oxoanion > chalcogen oxoanion > sulfur oxoanion > organosulfate oxoanion > steroid sulfate oxoanion > chenodeoxycholate 7-sulfate(2-)
... > chemical entity > molecular entity > ion > polyatomic ion > polyatomic anion > oxoanion > chalcogen oxoanion > sulfur oxoanion > organosulfate oxoanion > steroid sulfate oxoanion > chenodeoxycholate 7-sulfate(2-)
... > chemical entity > molecular entity > polyatomic entity > polyatomic ion > polyatomic anion > oxoanion > chalcogen oxoanion > sulfur oxoanion > organosulfate oxoanion > steroid sulfate oxoanion > chenodeoxycholate 7-sulfate(2-)
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxide > oxoanion > chalcogen oxoanion > sulfur oxoanion > organosulfate oxoanion > steroid sulfate oxoanion > chenodeoxycholate 7-sulfate(2-)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > chalcogen oxoanion > sulfur oxoanion > organosulfate oxoanion > steroid sulfate oxoanion > chenodeoxycholate 7-sulfate(2-)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > sulfur oxoanion > organosulfate oxoanion > steroid sulfate oxoanion > chenodeoxycholate 7-sulfate(2-)

Preferred term

chenodeoxycholate 7-sulfate(2-)  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • -2

formula

  • C24H38O7S

has_functional_parent

inchi

  • InChI=1S/C24H40O7S/c1-14(4-7-21(26)27)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)31-32(28,29)30/h14-20,22,25H,4-13H2,1-3H3,(H,26,27)(H,28,29,30)/p-2/t14-,15+,16-,17-,18+,19+,20-,22+,23+,24-/m1/s1

inchikey

  • DPVCTIYTPXYDMQ-BSWAIDMHSA-L

mass

  • 470.620

monoisotopicmass

  • 470.23492

smiles

  • C1[C@@]2([C@]3(CC[C@]4([C@]([C@@]3([C@@H](C[C@@]2(C[C@@H](C1)O)[H])OS([O-])(=O)=O)[H])(CC[C@@]4([C@@H](CCC([O-])=O)C)[H])[H])C)[H])C

subset

  • 2_STAR

synonym RELATED

  • chenodeoxycholate 7-sulfate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:172395

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