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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-(3-sulfo-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-(3-sulfo-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-(3-sulfo-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-(3-sulfo-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-(3-sulfo-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-(3-sulfo-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-(3-sulfo-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-(3-sulfo-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-(3-sulfo-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-(3-sulfo-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-(3-sulfo-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-(3-sulfo-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-(3-sulfo-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-(3-sulfo-beta-d-glucuronide) 17-sulfate(2-)

Preferred term

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

Type

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

Broader concept

charge

  • -3

formula

  • C24H29O14S2

inchi

  • InChI=1S/C24H32O14S2/c1-24-9-8-14-13-5-3-12(10-11(13)2-4-15(14)16(24)6-7-17(24)37-39(29,30)31)35-23-19(26)20(38-40(32,33)34)18(25)21(36-23)22(27)28/h3,5,10,14-21,23,25-26H,2,4,6-9H2,1H3,(H,27,28)(H,29,30,31)(H,32,33,34)/p-3/t14-,15-,16+,17+,18+,19-,20+,21+,23-,24+/m1/s1

inchikey

  • VFPGVQRZZWWOOK-ZDFSTSLFSA-K

mass

  • 605.600

monoisotopicmass

  • 605.10152

smiles

  • O([C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C([O-])=O)O)OS([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-(3-sulfo-beta-D-glucuronate) 17-sulfate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:178094

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