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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 > organic hydroxy compound > phenols > polyphenol > tannin > 6-[2,6-dihydroxy-4-(/{[4-hydroxy-6-(hydroxymethyl)-3,5-bis(3,4,5-trihydroxybenzoyloxy)oxan-2-yl]oxy/}carbonyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > phenols > polyphenol > tannin > 6-[2,6-dihydroxy-4-(/{[4-hydroxy-6-(hydroxymethyl)-3,5-bis(3,4,5-trihydroxybenzoyloxy)oxan-2-yl]oxy/}carbonyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenols > polyphenol > tannin > 6-[2,6-dihydroxy-4-(/{[4-hydroxy-6-(hydroxymethyl)-3,5-bis(3,4,5-trihydroxybenzoyloxy)oxan-2-yl]oxy/}carbonyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
... > 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 aromatic compound > phenols > polyphenol > tannin > 6-[2,6-dihydroxy-4-(/{[4-hydroxy-6-(hydroxymethyl)-3,5-bis(3,4,5-trihydroxybenzoyloxy)oxan-2-yl]oxy/}carbonyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenols > polyphenol > tannin > 6-[2,6-dihydroxy-4-(/{[4-hydroxy-6-(hydroxymethyl)-3,5-bis(3,4,5-trihydroxybenzoyloxy)oxan-2-yl]oxy/}carbonyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

Preferred term

6-[2,6-dihydroxy-4-(/{[4-hydroxy-6-(hydroxymethyl)-3,5-bis(3,4,5-trihydroxybenzoyloxy)oxan-2-yl]oxy/}carbonyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C33H32O24

inchi

  • InChI=1S/C33H32O24/c34-7-17-25(53-29(49)8-1-11(35)18(41)12(36)2-8)23(46)27(54-30(50)9-3-13(37)19(42)14(38)4-9)33(52-17)57-31(51)10-5-15(39)24(16(40)6-10)55-32-22(45)20(43)21(44)26(56-32)28(47)48/h1-6,17,20-23,25-27,32-46H,7H2,(H,47,48)

inchikey

  • YGMXNLLBQULTFW-UHFFFAOYSA-N

mass

  • 812.595

monoisotopicmass

  • 812.12835

smiles

  • O1C(C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C1OC(=O)C4=CC(O)=C(OC5OC(C(O)C(O)C5O)C(O)=O)C(O)=C4)CO

subset

  • 2_STAR

synonym EXACT

  • 6-[2,6-dihydroxy-4-[4-hydroxy-6-(hydroxymethyl)-3,5-bis[(3,4,5-trihydroxybenzoyl)oxy]oxan-2-yl]oxycarbonylphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:184983

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