Products 56317-09-0

CAS 56317-09-0 appears in our catalog under these names: Isoscutellarein 8-O-β-D-glucuronide, Isoscutellarein 8-O-glucuronide, ≥98%. Offered by: MedChemExpress, Chemat. Available pack sizes: 5 mg, 1 mg, 10 mg, 5mg.

Isoscutellarein 8-O-β-D-glucuronide
MedChemExpress
  • size: 5 mg, 1 mg, 10 mg
  • Variants: 3
from 1415.68
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Isoscutellarein 8-O-glucuronide, ≥98%
Chemat
  • size: 5mg
  • Variants: 1
from 2651.60
View product
Structural formula: {0} (CAS {1})

(2S,3S,4S,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-8-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid (CAS 56317-09-0) is a chemical compound with the molecular formula C21H18O12 and a molecular weight of 462.4 g/mol. IUPAC name: (2S,3S,4S,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-8-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid. InChIKey: FBDUYUDFMFZSDJ-ZUGPOPFOSA-N.

Identity
Molecular formulaC21H18O12
Molecular weight462.4 g/mol
IUPAC name(2S,3S,4S,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-8-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
InChIKeyFBDUYUDFMFZSDJ-ZUGPOPFOSA-N
SMILESC1=CC(=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)O

Computed by PubChem (NCBI)

Synonyms: Isoscutellarein 8-o-glucuronide, Isoscutellarein 8-glucuronide, 8-Hydroxyapigenin 8-o-glucuronide, Isoscutellarein 8-O-beta-D-glucuronide, Isoscutellarein 8-O-|A-D-glucuronide, isoscutellarein-8-O-glucuronide, orb1942740, Isoscutellarein 8-O--D-glucuronide
Isomers (same molecular formula)
(2S,3S,4S,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid C21H18O12
(2S,3S,4S,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxochromen-7-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid C21H18O12
(2S,3S,4S,5R,6S)-6-[3,5-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid C21H18O12
(2S,3S,4S,5R,6S)-6-[5-(5,7-dihydroxy-4-oxochromen-2-yl)-2-hydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid C21H18O12
(2S,3S,4S,5R,6S)-6-[5,6-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid C21H18O12
6,7-dihydroxy-14-methoxy-13-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione C21H18O12
6-[5,6-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid C21H18O12
6,14-dihydroxy-7-methoxy-13-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione C21H18O12
6-hydroxy-7,14-dimethoxy-13-(3,4,5-trihydroxyoxan-2-yl)oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione C21H18O12
(2S,3S,4S,5R,6S)-6-[4-(5,7-dihydroxy-4-oxochromen-2-yl)-2-hydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid C21H18O12

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