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Substance Name: 2',5,5',7-Tetrahydroxy-flavanone-7-O-rutinoside
RN: 153286-43-2
InChIKey: RCFNEUNACWDVIZ-KPCGAFGGSA-N

Molecular Formula

  • C27-H32-O15

Molecular Weight

  • 596.5348
 
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Names and Synonyms

Results Name

  • 2',5,5',7-Tetrahydroxy-flavanone-7-O-rutinoside

Synonym

  • 2',5,5',7-Tetrahydroxy-flavanone-7-O-rutinoside

Systematic Name

  • 2-(2,4-Dihydroxy-phenyl)-5-hydroxy-7-(3,4,5-trihydroxy-6-(3,4,5-trihydroxy-6-methyl-tetrahydro-pyran-2-yloxymethyl)-tetrahydro-pyran-2-yloxy)-1-benzopyran-4-one

Registry Numbers

CAS Registry Number

  • 153286-43-2

System Generated Number

  • 0153286432

Structure Descriptors

InChI

1S/C27H32O15/c1-9-20(32)22(34)24(36)26(39-9)38-8-18-21(33)23(35)25(37)27(42-18)40-11-5-14(30)19-15(31)7-16(41-17(19)6-11)12-3-2-10(28)4-13(12)29/h2-6,9,16,18,20-30,32-37H,7-8H2,1H3/t9-,16?,18+,20-,21+,22+,23-,24+,25+,26?,27+/m0/s1

InChIKey

RCFNEUNACWDVIZ-KPCGAFGGSA-N

Smiles

C[C@@H]1OC(OC[C@H]2O[C@@H](Oc3cc(O)c4C(=O)CC(Oc4c3)c5ccc(O)cc5O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O