skip to main content

Chemistry, part 2

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > kaempferol 3-isorhamninoside-7-rhamnoside
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > flavonoids > kaempferol 3-isorhamninoside-7-rhamnoside

Preferred term

kaempferol 3-isorhamninoside-7-rhamnoside  

Type

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

Broader concept

charge

  • 0

formula

  • C39H50O23

inchi

  • InChI=1S/C39H50O23/c1-11-21(42)25(46)29(50)37(55-11)58-16-8-17(41)20-18(9-16)59-34(14-4-6-15(40)7-5-14)35(24(20)45)62-39-31(52)27(48)23(44)19(60-39)10-54-36-32(53)28(49)33(13(3)57-36)61-38-30(51)26(47)22(43)12(2)56-38/h4-9,11-13,19,21-23,25-33,36-44,46-53H,10H2,1-3H3/t11?,12?,13?,19?,21-,22-,23-,25-,26-,27?,28+,29?,30?,31?,32?,33-,36+,37-,38-,39-/m0/s1

inchikey

  • MFMPPIGSYYTBKG-OQNHFBIPSA-N

mass

  • 886.806

monoisotopicmass

  • 886.27429

smiles

  • O([C@@H]1[C@H](O)C(O)[C@@H](OC1C)OCC2O[C@@H](OC3=C(OC=4C(C3=O)=C(O)C=C(O[C@@H]5OC([C@H](O)[C@H](O)C5O)C)C4)C6=CC=C(O)C=C6)C(O)C(O)[C@H]2O)[C@@H]7OC([C@H](O)[C@H](O)C7O)C

subset

  • 2_STAR

synonym EXACT

  • 3-[(2S,5R)-6-[[(2R,4R,5R)-3,4-dihydroxy-6-methyl-5-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)-7-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:185647

Download this concept:

RDF/XML TURTLE JSON-LD