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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 > isoprenoid > terpenoid > diterpenoid > diterpene glycoside > rac-4-hydroxy-4-o-(beta-d-glucuronide)-all-trans-retinyl acetate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > diterpenoid > diterpene glycoside > rac-4-hydroxy-4-o-(beta-d-glucuronide)-all-trans-retinyl acetate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > terpene glycoside > diterpene glycoside > rac-4-hydroxy-4-o-(beta-d-glucuronide)-all-trans-retinyl acetate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > terpene glycoside > diterpene glycoside > rac-4-hydroxy-4-o-(beta-d-glucuronide)-all-trans-retinyl acetate
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > terpene glycoside > diterpene glycoside > rac-4-hydroxy-4-o-(beta-d-glucuronide)-all-trans-retinyl acetate

Preferred term

rac-4-hydroxy-4-o-(beta-d-glucuronide)-all-trans-retinyl acetate  

Type

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

Broader concept

charge

  • 0

formula

  • C28H40O9

inchi

  • InChI=1S/C28H40O9/c1-16(8-7-9-17(2)13-15-35-19(4)29)10-11-20-18(3)21(12-14-28(20,5)6)36-27-24(32)22(30)23(31)25(37-27)26(33)34/h7-11,13,21-25,27,30-32H,12,14-15H2,1-6H3,(H,33,34)/b9-7+,11-10+,16-8+,17-13+/t21-,22-,23+,24-,25-,27-/m1/s1

inchikey

  • LFXATGINAILLFU-BSJULFBXSA-N

mass

  • 520.619

monoisotopicmass

  • 520.26723

smiles

  • O([C@@H]1CCC(C(=C1C)/C=C/C(/C)=C/C=C/C(/C)=C/COC(=O)C)(C)C)[C@@H]2O[C@H]([C@@H](O)[C@@H](O)[C@H]2O)C(O)=O

subset

  • 2_STAR

synonym EXACT

  • (2R,3S,4R,5R,6R)-6-[(1R)-3-[(1E,3E,5E,7E)-9-acetyloxy-3,7-dimethylnona-1,3,5,7-tetraenyl]-2,4,4-trimethylcyclohex-2-en-1-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:183630

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