Baohuoside I

enlarge

Systematic / IUPAC Name: 5,7-Dihydroxy-2-(4-methoxyphenyl)-8-(3-methyl-2-buten-1-yl)-4-oxo-4H-chromen-3-yl 6-deoxyhexopyranoside

ID: Reference652

Other Names: 4H-1-Benzopyran-4-one, 3-((6-deoxy-α-L-mannopyranosyl)oxy)-5,7-dihydroxy-2-(4-methoxyphenyl)-8-(3-methyl-2-butenyl)-;
Icariside II

Formula: C27H30O10

Class: Endogenous Metabolites Natural Products/Medicines

Spectral Data

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

View Mass Spectra

Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 75
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/17/2015 2:05:58 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C27H30O10/c1-12(2)5-10-16-17(28)11-18(29)19-21(31)26(37-27-23(33)22(32)20(30)13(3)35-27)24(36-25(16)19)14-6-8-15(34-4)9-7-14/h5-9,11,13,20,22-23,27-30,32-33H,10H2,1-4H3/t13-,20-,22+,23+,27-/m0/s1
InChI Key NGMYNFJANBHLKA-LVKFHIPRSA-N
Canonical SMILES
CAS 113558159
Splash
Other Names 4H-1-Benzopyran-4-one, 3-((6-deoxy-α-L-mannopyranosyl)oxy)-5,7-dihydroxy-2-(4-methoxyphenyl)-8-(3-methyl-2-butenyl)-;
Icariside II

In Other Databases

PubChem 5488822
ChemIDPlus 113558159
ChEMBL CHEMBL560116
ChemSpider 11654766