Met001673: 2''-O-p-Coumaroylvitexin
Metabolite Information
Name
2''-O-p-Coumaroylvitexin
IUPAC Name
[2-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-8-yl]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
Molecular Formula
C30H26O12
Molecular Weight
578.5
Exact Mass
578.1424263
SMILES
C1=CC(=CC=C1C=CC(=O)OC2C(C(C(OC2C3=C(C=C(C4=C3OC(=CC4=O)C5=CC=C(C=C5)O)O)O)CO)O)O)O
InChIKey
FJGOEBQRHWKKJH-XCVCLJGOSA-N
InChI
InChI=1S/C30H26O12/c31-13-22-26(38)27(39)30(42-23(37)10-3-14-1-6-16(32)7-2-14)29(41-22)25-19(35)11-18(34)24-20(36)12-21(40-28(24)25)15-4-8-17(33)9-5-15/h1-12,22,26-27,29-35,38-39H,13H2/b10-3+
Other Databases Link
Structure
2D Structure
3D Structure
Classification
(data sourced from ClassyFire)
Kingdom:
Organic compounds
Superclass:
Phenylpropanoids and polyketides
Class:
Flavonoids
Subclass:
Flavonoid glycosides
Crops containing this metabolite
adzuki_bean
avocado
banana
blueberry
chestnut
cowpea
fig
ginger
grape
kidney_bean
kiwifruit
lentil
loquat
mango
mung_bean
peach
pear
taro
yam
avocado
banana
blueberry
chestnut
cowpea
fig
ginger
grape
kidney_bean
kiwifruit
lentil
loquat
mango
mung_bean
peach
pear
taro
yam
Metabolite Spectrum Accession Label
ADZ00042p
ADZ00063n
ADZ00098n
ADZ00243p
ADZ00293p
ADZ00311n
ADZ00391p
ADZ00407p
ADZ00463n
ADZ00496p
ADZ00502n
ADZ00547n
ADZ00626p
ADZ00633n
ADZ00693n
ADZ00698n
AVO00603n
AVO00608n
AVO00670p
AVO01144n
BAN00045p
BAN00213n
BAN00233n
BAN00270n
BAN00288n
BLU00043p
BLU00071n
BLU00090n
BLU00140n
BLU00249n
BLU00252p
BLU00314p
BLU00503n
BLU00506p
BLU00601p
CHE00225n
CHE00292n
CHE00664n
COW00042p
COW00117n
COW00137n
COW00207p
COW00261n
COW00279p
COW00307n
COW00325n
COW00356n
COW00410n
COW00472p
COW00550n
COW00718p
FIG00226n
FIG00328n
FIG00489p
GIN00080n
GIN00152n
GIN00305p
GIN00658n
GIN00763p
GIN01386n
GIN01417n
GIN01601p
GRA00098n
GRA00232n
GRA00236p
GRA00278n
GRA00395n
KID00012p
KID00042p
KID00264p
KID00271n
KID00297p
KID00314p
KID00315n
KID00409p
KID00496n
KID00566n
KID00614n
KID00655p
KID00717n
KID00745p
KID00863n
KIW00031p
KIW00101n
KIW00588n
LEN00125p
LEN00143p
LEN00173n
LEN00440n
LEN00447n
LEN00448n
LEN00565n
LEN00813p
LOQ00024n
LOQ00096p
LOQ00154n
LOQ00179p
LOQ00220p
LOQ00258n
LOQ00406n
LOQ00419n
LOQ00453n
LOQ00462p
MAN00565n
MUN00384n
PEACH00004p
PEACH00005n
PEACH00007n
PEACH00146p
PEACH00314n
PEACH00425n
PEACH00478n
PEACH00491p
PEACH00527n
PEACH00570n
PEACH00585n
PEAR00271n
TAR00020p
TAR00100p
TAR00121p
TAR00122p
TAR00187p
YAM00230n
YAM00251p
YAM00299p
YAM00375n
YAM00396n
ADZ00063n
ADZ00098n
ADZ00243p
ADZ00293p
ADZ00311n
ADZ00391p
ADZ00407p
ADZ00463n
ADZ00496p
ADZ00502n
ADZ00547n
ADZ00626p
ADZ00633n
ADZ00693n
ADZ00698n
AVO00603n
AVO00608n
AVO00670p
AVO01144n
BAN00045p
BAN00213n
BAN00233n
BAN00270n
BAN00288n
BLU00043p
BLU00071n
BLU00090n
BLU00140n
BLU00249n
BLU00252p
BLU00314p
BLU00503n
BLU00506p
BLU00601p
CHE00225n
CHE00292n
CHE00664n
COW00042p
COW00117n
COW00137n
COW00207p
COW00261n
COW00279p
COW00307n
COW00325n
COW00356n
COW00410n
COW00472p
COW00550n
COW00718p
FIG00226n
FIG00328n
FIG00489p
GIN00080n
GIN00152n
GIN00305p
GIN00658n
GIN00763p
GIN01386n
GIN01417n
GIN01601p
GRA00098n
GRA00232n
GRA00236p
GRA00278n
GRA00395n
KID00012p
KID00042p
KID00264p
KID00271n
KID00297p
KID00314p
KID00315n
KID00409p
KID00496n
KID00566n
KID00614n
KID00655p
KID00717n
KID00745p
KID00863n
KIW00031p
KIW00101n
KIW00588n
LEN00125p
LEN00143p
LEN00173n
LEN00440n
LEN00447n
LEN00448n
LEN00565n
LEN00813p
LOQ00024n
LOQ00096p
LOQ00154n
LOQ00179p
LOQ00220p
LOQ00258n
LOQ00406n
LOQ00419n
LOQ00453n
LOQ00462p
MAN00565n
MUN00384n
PEACH00004p
PEACH00005n
PEACH00007n
PEACH00146p
PEACH00314n
PEACH00425n
PEACH00478n
PEACH00491p
PEACH00527n
PEACH00570n
PEACH00585n
PEAR00271n
TAR00020p
TAR00100p
TAR00121p
TAR00122p
TAR00187p
YAM00230n
YAM00251p
YAM00299p
YAM00375n
YAM00396n