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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > ion > anion > polyatomic anion > oxoanion > carboxylic acid anion > carbohydrate acid derivative anion > steroid glucosiduronic acid anion > 17beta-estradiol 3-o-(beta-d-glucuronide) 17-sulfate (2-)
... > chemical entity > molecular entity > ion > polyatomic ion > polyatomic anion > oxoanion > carboxylic acid anion > carbohydrate acid derivative anion > steroid glucosiduronic acid anion > 17beta-estradiol 3-o-(beta-d-glucuronide) 17-sulfate (2-)
... > chemical entity > molecular entity > polyatomic entity > polyatomic ion > polyatomic anion > oxoanion > carboxylic acid anion > carbohydrate acid derivative anion > steroid glucosiduronic acid anion > 17beta-estradiol 3-o-(beta-d-glucuronide) 17-sulfate (2-)
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxide > oxoanion > carboxylic acid anion > carbohydrate acid derivative anion > steroid glucosiduronic acid anion > 17beta-estradiol 3-o-(beta-d-glucuronide) 17-sulfate (2-)
... > chemical entity > molecular entity > ion > anion > organic anion > carboxylic acid anion > carbohydrate acid derivative anion > steroid glucosiduronic acid anion > 17beta-estradiol 3-o-(beta-d-glucuronide) 17-sulfate (2-)
... > chemical entity > molecular entity > ion > organic ion > organic anion > carboxylic acid anion > carbohydrate acid derivative anion > steroid glucosiduronic acid anion > 17beta-estradiol 3-o-(beta-d-glucuronide) 17-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 > carboxylic acid anion > carbohydrate acid derivative anion > steroid glucosiduronic acid anion > 17beta-estradiol 3-o-(beta-d-glucuronide) 17-sulfate (2-)
... > chemical entity > molecular entity > ion > anion > polyatomic anion > oxoanion > carboxylic acid anion > steroid acid anion > steroid glucosiduronic acid anion > 17beta-estradiol 3-o-(beta-d-glucuronide) 17-sulfate (2-)
... > chemical entity > molecular entity > ion > polyatomic ion > polyatomic anion > oxoanion > carboxylic acid anion > steroid acid anion > steroid glucosiduronic acid anion > 17beta-estradiol 3-o-(beta-d-glucuronide) 17-sulfate (2-)
... > chemical entity > molecular entity > polyatomic entity > polyatomic ion > polyatomic anion > oxoanion > carboxylic acid anion > steroid acid anion > steroid glucosiduronic acid anion > 17beta-estradiol 3-o-(beta-d-glucuronide) 17-sulfate (2-)
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxide > oxoanion > carboxylic acid anion > steroid acid anion > steroid glucosiduronic acid anion > 17beta-estradiol 3-o-(beta-d-glucuronide) 17-sulfate (2-)
... > chemical entity > molecular entity > ion > anion > organic anion > carboxylic acid anion > steroid acid anion > steroid glucosiduronic acid anion > 17beta-estradiol 3-o-(beta-d-glucuronide) 17-sulfate (2-)
... > chemical entity > molecular entity > ion > organic ion > organic anion > carboxylic acid anion > steroid acid anion > steroid glucosiduronic acid anion > 17beta-estradiol 3-o-(beta-d-glucuronide) 17-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 > carboxylic acid anion > steroid acid anion > steroid glucosiduronic acid anion > 17beta-estradiol 3-o-(beta-d-glucuronide) 17-sulfate (2-)

Preferred term

17beta-estradiol 3-o-(beta-d-glucuronide) 17-sulfate (2-)  

Type

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

Broader concept

charge

  • -2

formula

  • C24H30O11S

inchi

  • InChI=1S/C24H32O11S/c1-24-9-8-14-13-5-3-12(33-23-20(27)18(25)19(26)21(34-23)22(28)29)10-11(13)2-4-15(14)16(24)6-7-17(24)35-36(30,31)32/h3,5,10,14-21,23,25-27H,2,4,6-9H2,1H3,(H,28,29)(H,30,31,32)/p-2/t14-,15-,16+,17+,18+,19+,20-,21+,23-,24+/m1/s1

inchikey

  • XZXBPAODZJETKT-QXYWQCSFSA-L

mass

  • 526.550

monoisotopicmass

  • 526.15198

smiles

  • O([C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C([O-])=O)O)O)O)C2=CC3=C([C@@]4([C@]([C@]5([C@@]([C@@H](OS([O-])(=O)=O)CC5)(CC4)C)[H])(CC3)[H])[H])C=C2

subset

  • 2_STAR

synonym RELATED

  • 17beta-estradiol 3-O-(beta-D-glucuronate) 17-sulfate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:178095

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