(Q63398320)

inferred from SMILES

mass

594.15847026 dalton

1 reference

2 references

3-[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one

2 references

3-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one

2 references

3-[(2R,3S,4R,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one

2 references

3-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one

2 references

Kaempferol-3-glucorhamnoside

1 reference

3-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one

1 reference

Kaempferol 3-neohesperidoside

1 reference

chemical formula

C₂₇H₃₀O₁₅

0 references

canonical SMILES

O=C1C(OC2OC(CO)C(O)C(O)C2OC3OC(C)C(O)C(O)C3O)=C(OC=4C=C(O)C=C(O)C14)C=5C=CC(O)=CC5

0 references

isomeric SMILES

C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)CO)O)O)O)O)O

0 references

found in taxon

Ocimum gratissimum

1 reference

The application of atmospheric pressure chemical ionisation liquid chromatography-mass spectrometry in the chemotaxonomic study of flavonoids: characterisation of flavonoids from Ocimum gratissimum var. gratissimum

Gossypium hirsutum

1 reference

High-performance liquid chromatography of cottonseed flavonoids

soybean

1 reference

HPLC separation and relative quantitation of kaempferol glycosides in soybean

Alangium platanifolium

2 references

Alangifolioside, a diphenylmethylene derivative, and other phenolics from the leaves of Alangium platanifolium var. trilobum

Alangifolioside, a diphenylmethylene derivative, and other phenolics from the leaves of Alangium platanifolium var. trilobum

Allium ampeloprasum

1 reference

The flavonoids of leek, Allium porrum.

Costus spiralis

1 reference

Flavonol glycosides from leaves of Costus spiralis.

Eriobotrya japonica

1 reference

Flavonoids from Eriobotrya japonica (Rosaceae) growing in Tunisia

Sambucus nigra

1 reference

Potential allelochemicals from Sambucus nigra

Tordylium apulum

1 reference

Flavonoids and bioactive coumarins of Tordylium apulum

Acer mandshuricum

1 reference

Chemical Constituents from Acer mandshuricum and Their Effects on the Function of Osteoblastic MC3T3-E1 Cells

Allium neapolitanum

1 reference

The flavonoids of Allium neapolitanum

Allium ursinum

1 reference

The flavonoids of Allium neapolitanum

Clitoria ternatea

2 references

Flavonoid composition related to petal color in different lines of Clitoria ternatea.

Malonylated flavonol glycosides from the petals of Clitoria ternatea.

Crocus antalyensis

1 reference

Flavonol glycosides from flowers of Crocus speciosus and C. antalyensis

Diospyros cathayensis

1 reference

Flavonol glycosides in leaves of two Diospyros species

Ficus pandurata

1 reference

Chemical composition of the stem bark and leaves of Ficus pandurata Hance

Hylocereus undatus

1 reference

Three new glycosides from Hylocereus undatus

Mallotus macrostachyus

1 reference

Chemical constituents of Mallotus macrostachyus growing in Vietnam and cytotoxic activity of some cycloartane derivatives

Mallotus metcalfianus

1 reference

Polyphenols isolated from antiradical extracts of Mallotus metcalfianus.

Primula hirsuta

1 reference

Comparative phytochemical and morphological analyses of three Italian Primula species

Selenicereus undatus

1 reference

Three new glycosides from Hylocereus undatus

Crataegus monogyna

1 reference

8-Methoxykaempferol 3-neohesperidoside and other flavonoids from bee pollen of Crataegus monogyna

Typha angustifolia

1 reference

Simultaneous determination of eleven major flavonoids in the pollen of Typha angustifolia by HPLC-PDA-MS

Identifiers

InChI

InChI=1S/C27H30O15/c1-9-17(32)20(35)22(37)26(38-9)42-25-21(36)18(33)15(8-28)40-27(25)41-24-19(34)16-13(31)6-12(30)7-14(16)39-23(24)10-2-4-11(29)5-3-10/h2-7,9,15,17-18,20-22,25-33,35-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,25+,26-,27-/m0/s1

0 references

0 references

CAS Registry Number

32602-81-6

1 reference

CAS (formerly Chemical Abstracts Service)

retrieved

25 January 2022

PubChem CID

5318761

1 reference

ChEBI ID

185334

mapping relation type

exact match

2 references

ChEBI release 2022-06-13

International Chemical Identifier

InChI

InChI=1S/C27H30O15/c1-9-17(32)20(35)22(37)26(38-9)42-25-21(36)18(33)15(8-28)40-27(25)41-24-19(34)16-13(31)6-12(30)7-14(16)39-23(24)10-2-4-11(29)5-3-10/h2-7,9,15,17-18,20-22,25-33,35-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,25+,26-,27-/m0/s1

1 reference

MassBank accession ID

MSBNK-Univ_Toyama-TY000226

0 references

MSBNK-Univ_Toyama-TY000227

0 references

MSBNK-BS-BS001028

0 references

MSBNK-BS-BS001029

0 references

MSBNK-BS-BS001030

0 references

MSBNK-IPB_Halle-PN000125

0 references

MSBNK-IPB_Halle-PN000126

0 references

DSSTox substance ID

DTXSID201304657

1 reference

Human Metabolome Database ID

HMDB0302645

2 references

KNApSAcK ID

C00061726

2 references

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

0 references

1 reference

retrieved

15 January 2022