apigenin 7-O-[β-D-apiosyl-(1→2)-β-D-glucoside]

Chemical Formula:

C₂₆H₂₈O₁₄

Molecular Weight:

564.499 Daltons

Monoisotopic Mass:

564.1479056082 Daltons

SMILES:

C5(OC(OC4(C(O)C(O)C(CO)OC(OC1(C=C(O)C2(C(=O)C=C(OC(C=1)=2)C3(=CC=C(O)C=C3))))4))C(O)C(O)(CO)5)

InChI:

1S/C26H28O14/c27-8-18-20(32)21(33)22(40-25-23(34)26(35,9-28)10-36-25)24(39-18)37-13-5-14(30)19-15(31)7-16(38-17(19)6-13)11-1-3-12(29)4-2-11/h1-7,18,20-25,27-30,32-35H,8-10H2/t18-,20-,21+,22-,23+,24-,25?,26-/m1/s1

InChIKey:

NTDLXWMIWOECHG-LKXHPMIISA-N

Synonyms

apiin
apioside
7-[(2-O-D-apio-β-D-furanosyl-β-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxy-phenyl)-4H-1-benzopyran-4-one
7-O-(β-D-apiofuranosyl-(1-2)-β-D-glucosyl)-5,7,4'-trihydroxyflavone
7-O-(β-D-apiofuranosyl-(1-2)-β-D-glucosyl)-apigenin

Databases

MetaCyc: 7-O-BETA-D-APIOFURANOSYL-12-BETA-D-GLU

HMDB: HMDB30843

LIPID MAPS: LMPK12110337

ChEBI: 15932

PubChem (CID): 25244999

KEGG: C04858

CAS: 26544-34-3

Seed: cpd02952

MetaNetX: MNXM5582