Kaempferitrin

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Systematic / IUPAC Name: 3-[(6-Deoxy-α-L-mannopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl 6-deoxy-α-L-mannopyranoside

ID: Reference6207

Other Names: Kaempferol 3,7-bisrhamnoside;
Kaempferol 3,7-dirhamnoside;
Kaempferol-3,7-O-α-L-dirhamnoside;
Kaempferol-dirhamnoside;
Lespedin ; more

Formula: C27H30O14

Class: Endogenous Metabolites Natural Products/Medicines

Spectral Data

Kaempferitrin mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 1
No. of Spectra 5972
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6, MS7
Ionization Methods NSI
Analyzers IT; FT
Last Modification 1/12/2017 1:04:42 PM
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Identificators

InChI InChI=1S/C27H30O14/c1-9-17(30)20(33)22(35)26(37-9)39-13-7-14(29)16-15(8-13)40-24(11-3-5-12(28)6-4-11)25(19(16)32)41-27-23(36)21(34)18(31)10(2)38-27/h3-10,17-18,20-23,26-31,33-36H,1-2H3/t9-,10-,17-,18-,20+,21+,22+,23+,26-,27-/m0/s1
InChI Key PUPKKEQDLNREIM-QNSQPKOQSA-N
Canonical SMILES CC1C(C(C(C(O1)OC2=CC(=C3C(=C2)OC(=C(C3=O)OC4C(C(C(C(O4)C)O)O)O)C5=CC=C(C=C5)O)O)O)O)O
CAS 482382
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Other Names Kaempferol 3,7-bisrhamnoside;
Kaempferol 3,7-dirhamnoside;
Kaempferol-3,7-O-α-L-dirhamnoside;
Kaempferol-dirhamnoside;
Lespedin;
Lespenefril;
Lespenephril;
Lespenephryl;
3,7-Bis[(6-deoxy-α-L-mannopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one ;
4H-1-Benzopyran-4-one,3,7-bis[(6-deoxy-a-L-mannopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-;
5-Hydroxy-2-(4-hydroxyphenyl)-3,7-bis{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}chromen-4-one ;
5-Hydroxy-2-(4-hydroxyphenyl)-3,7-bis{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy}chromen-4-one

In Other Databases

Wikipedia Kaempferitrin
ChEBI CHEBI:68883
ChemIDPlus 000482382
PubChem 5486199
ChemSpider 4588900
ChEMBL CHEMBL251766
KEGG C16981