Naringin dihydrochalcone

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Systematic / IUPAC Name: 3,5-Dihydroxy-4-[3-(4-hydroxyphenyl)propanoyl]phenyl 2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside

ID: Reference3479

Other Names: 1-Propanone, 1-(4{[2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy}-2,6-dihydroxyphenyl)-3-(4-hydroxyphenyl)-

Formula: C27H34O14

Class: Endogenous Metabolites Excipients/Additives/Colorants

Spectral Data

Naringin dihydrochalcone 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; Orbitrap ID-X with ETD_Cal Gateshead
No. of Spectral Trees 3
No. of Spectra 12864
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6, MS7, MS8
Ionization Methods NSI
Analyzers IT; FT
Last Modification 12/10/2015 8:43:26 AM
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Identificators

InChI InChI=1S/C27H34O14/c1-11-20(33)22(35)24(37)26(38-11)41-25-23(36)21(34)18(10-28)40-27(25)39-14-8-16(31)19(17(32)9-14)15(30)7-4-12-2-5-13(29)6-3-12/h2-3,5-6,8-9,11,18,20-29,31-37H,4,7,10H2,1H3/t11-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1
InChI Key CWBZAESOUBENAP-QVNVHUMTSA-N
Canonical SMILES CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C(C(=C3)O)C(=O)CCC4=CC=C(C=C4)O)O)CO)O)O)O)O)O
CAS 18916171
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Other Names 1-Propanone, 1-(4{[2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy}-2,6-dihydroxyphenyl)-3-(4-hydroxyphenyl)-

In Other Databases

Wikipedia Naringin dihydrochalcone
ChemSpider 8070254
PubChem 9894584