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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > steroid > cholanoid > bile acids > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > cholanoid > bile acids > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > cholanoid > bile acids > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > cholanoid > bile acids > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > cholanoid > bile acids > bile acid > chenodeoxycholic acid disulfate
... > organooxygen compound > carbonyl compound > carboxylic acid > monocarboxylic acid > bile acids > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > carboxylic acid > monocarboxylic acid > bile acids > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic acid > monocarboxylic acid > bile acids > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic acid > carboxylic acid > monocarboxylic acid > bile acids > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > hydroxy steroid > bile acids > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > hydroxy steroid > bile acids > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > steroid > hydroxy steroid > bile acids > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > hydroxy steroid > bile acids > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > hydroxy steroid > bile acids > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > hydroxy steroid > bile acids > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > hydroxy steroid > bile acids > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > hydroxy-5beta-cholanic acid > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > hydroxy-5beta-cholanic acid > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > steroid > 5beta steroid > 5beta-cholanic acids > hydroxy-5beta-cholanic acid > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > 5beta steroid > 5beta-cholanic acids > hydroxy-5beta-cholanic acid > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > 5beta steroid > 5beta-cholanic acids > hydroxy-5beta-cholanic acid > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > 5beta steroid > 5beta-cholanic acids > hydroxy-5beta-cholanic acid > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > 5beta steroid > 5beta-cholanic acids > hydroxy-5beta-cholanic acid > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > steroid > cholanoid > cholanic acids > 5beta-cholanic acids > hydroxy-5beta-cholanic acid > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > cholanoid > cholanic acids > 5beta-cholanic acids > hydroxy-5beta-cholanic acid > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > cholanoid > cholanic acids > 5beta-cholanic acids > hydroxy-5beta-cholanic acid > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > cholanoid > cholanic acids > 5beta-cholanic acids > hydroxy-5beta-cholanic acid > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > cholanoid > cholanic acids > 5beta-cholanic acids > hydroxy-5beta-cholanic acid > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic acid > steroid acid > cholanic acids > 5beta-cholanic acids > hydroxy-5beta-cholanic acid > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > steroid > steroid acid > cholanic acids > 5beta-cholanic acids > hydroxy-5beta-cholanic acid > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > steroid acid > cholanic acids > 5beta-cholanic acids > hydroxy-5beta-cholanic acid > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > steroid acid > cholanic acids > 5beta-cholanic acids > hydroxy-5beta-cholanic acid > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > steroid acid > cholanic acids > 5beta-cholanic acids > hydroxy-5beta-cholanic acid > bile acid > chenodeoxycholic acid disulfate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > steroid acid > cholanic acids > 5beta-cholanic acids > hydroxy-5beta-cholanic acid > bile acid > chenodeoxycholic acid disulfate

Preferred term

chenodeoxycholic acid disulfate  

Type

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

Broader concept

charge

  • 0

formula

  • C24H40O10S2

inchi

  • InChI=1S/C24H40O10S2/c1-14(4-7-21(25)26)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(33-35(27,28)29)12-15(23)13-20(22)34-36(30,31)32/h14-20,22H,4-13H2,1-3H3,(H,25,26)(H,27,28,29)(H,30,31,32)/t14-,15+,16-,17-,18+,19+,20-,22+,23+,24-/m1/s1

inchikey

  • BWXSDJHAJWTEAD-BSWAIDMHSA-N

mass

  • 552.690

monoisotopicmass

  • 552.20629

smiles

  • S(O[C@H]1[C@]2([C@]3([C@@]([C@](CC3)([C@@H](CCC(O)=O)C)[H])(CC[C@@]2([C@@]4([C@](C1)(C[C@H](OS(O)(=O)=O)CC4)[H])C)[H])C)[H])[H])(O)(=O)=O

subset

  • 2_STAR

synonym EXACT

  • (4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-3,7-disulooxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:166726

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