Naringin 6′′-malonate

CAS Registry Number®

139934-59-1

CAS Name

Naringin 6′′-malonate

Molecular Formula

C30H34O17

Molecular Mass

666.58

Cite this Page

Naringin 6′′-malonate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=139934-59-1 (retrieved 2024-11-21) (CAS RN: 139934-59-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C30H34O17/c1-11-23(37)25(39)27(41)29(43-11)47-28-26(40)24(38)19(10-42-21(36)9-20(34)35)46-30(28)44-14-6-15(32)22-16(33)8-17(45-18(22)7-14)12-2-4-13(31)5-3-12/h2-7,11,17,19,23-32,37-41H,8-10H2,1H3,(H,34,35)/t11-,17-,19+,23-,24+,25+,26-,27+,28+,29-,30+/m0/s1

InChIKey

InChIKey=YCOQCRMFNLZUCL-PGGWDMDASA-N

SMILES

O=C1C=2C(O[C@@H](C1)C3=CC=C(O)C=C3)=CC(O[C@H]4[C@H](O[C@H]5[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O5)[C@@H](O)[C@H](O)[C@@H](COC(CC(O)=O)=O)O4)=CC2O

Canonical SMILES

O=C(O)CC(=O)OCC1OC(OC2=CC(O)=C3C(=O)CC(OC3=C2)C4=CC=C(O)C=C4)C(OC5OC(C)C(O)C(O)C5O)C(O)C1O

Other Names for this Substance

  • 4H-1-Benzopyran-4-one, 7-[[6-O-(2-carboxyacetyl)-2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-, (2S)-
  • 4H-1-Benzopyran-4-one, 7-[[6-O-(carboxyacetyl)-2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-, (S)-
  • 4H-1-Benzopyran-4-one, 7-[[6-O-(carboxyacetyl)-2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-, (2S)-
  • (2S)-7-[[6-O-(2-Carboxyacetyl)-2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
  • Naringin 6′′-malonate

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