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2''-O-(beta-D-glucosyl)isovitexin

MNXM4627 is deprecated and here replaced by MNXM61368
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM61368 Image of MNXM61368
referencechebi:75432
formulaC27H30O15
global charge0
mol weight594.522
InChIKeyRQTTXGQDIROLTQ-FASGCTRLSA-N
InChIInChI=1S/C27H30O15/c28-7-15-20(34)23(37)26(42-27-24(38)22(36)19(33)16(8-29)41-27)25(40-15)18-12(32)6-14-17(21(18)35)11(31)5-13(39-14)9-1-3-10(30)4-2-9/h1-6,15-16,19-20,22-30,32-38H,7-8H2/t15-,16-,19-,20-,22+,23+,24-,25+,26-,27+/m1/s1
SMILESO=C1C=C(C2=CC=C(O)C=C2)OC2=CC(O)=C([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(O)=C12
MNX internals
InChI (mnx)InChI=1/C27H30O15/c28-7-15-20(34)23(37)26(42-27-24(38)22(36)19(33)16(8-29)41-27)25(40-15)18-12(32)6-14-17(21(18)35)11(31)5-13(39-14)9-1-3-10(30)4-2-9/h1-6,15-16,19-20,22-30,32-38H,7-8H2/t15-,16-,19-,20-,22+,23+,24-,25+,26-,27+/m1/s1 Image of MNXM61368
SMILES (mnx)[CH:1]1=[CH:3][C:10]([OH:30])=[CH:4][CH:2]=[C:9]1[C:13]1=[CH:5][C:11](=[O:31])[C:17]2=[C:14]([CH:6]=[C:12]([OH:32])[C:18]([C@H:25]3[C@H:26]([O:42][C@H:27]4[C@H:24]([OH:38])[C@@H:22]([OH:36])[C@H:19]([OH:33])[C@@H:16]([CH2:8][OH:29])[O:41]4)[C@@H:23]([OH:37])[C@H:20]([OH:34])[C@@H:15]([CH2:7][OH:28])[O:40]3)=[C:21]2[OH:35])[O:39]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:75432
chebi:75432
RQTTXGQDIROLTQ-FASGCTRLSA-N 		2''-O-(beta-D-glucosyl)isovitexin
(1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4HH-chromen-6-yl]-2-O-beta-D-glucopyranosyl-D-glucitol
2'-O-beta-D-glucosylisovitexin
Meloside A
isovitexin 2''-O-glucoside
isovitexin 2''-beta-D-O-glucoside

kegg.compound:C04199
keggC:C04199
RQTTXGQDIROLTQ-FASGCTRLSA-N 		Isovitexin 2''-O-beta-D-glucoside
Isovitexin 2''-O-glucoside
Meloside A

seed.compound:cpd02579
seedM:cpd02579
RQTTXGQDIROLTQ-FASGCTRLSA-M 		Isovitexin 2''-O-beta-D-glucoside
isovitexin 2''-O-beta-D-glucoside

vmhM:ivitxn2oglc
vmhmetabolite:ivitxn2oglc
RQTTXGQDIROLTQ-FLJXCGGLSA-N 		Isovitexin 2-O-beta-D-glucoside
6-[4,5-dihydroxy-6-(hydroxymethyl)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one

lipidmaps:LMPK12110217
lipidmapsM:LMPK12110217
RQTTXGQDIROLTQ-FASGCTRLSA-N 		Meloside A
Isovitexin 2''-O-glucoside
hmdb:HMDB0302583
RQTTXGQDIROLTQ-FASGCTRLSA-N 		Meloside
2''-O-(b-D-Glucosyl)isovitexin
2''-O-(beta-D-glucosyl)isovitexin
2'-O-b-D-Glucosylisovitexin
2'-O-beta-D-Glucosylisovitexin
2'-O-beta-D-glucosylisovitexin
6-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one
Isovitexin 2''-O-b-D-glucoside
Isovitexin 2''-O-beta-D-glucoside
Isovitexin 2''-O-beta-glucoside
Isovitexin 2''-O-glucoside
Isovitexin 2''-b-D-O-glucoside
Isovitexin 2''-beta-D-O-glucoside
Meloside a
isovitexin 2''-O-beta-D-glucoside

metacyc.compound:ISOVITEXIN-2-O-B-D-GLUCOSIDE
metacycM:ISOVITEXIN-2-O-B-D-GLUCOSIDE
RQTTXGQDIROLTQ-FASGCTRLSA-M 		isovitexin 2''-O-beta-D-glucoside

CHEBI:17379
chebi:17379
RQTTXGQDIROLTQ-FLJXCGGLSA-N 		isovitexin 2''-O-beta-D-glucoside
(1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-6-yl]-2-O-beta-D-glucopyranosyl-D-glucitol
Isovitexin 2''-O-beta-D-glucoside
Meloside A

CHEBI:58124
chebi:58124
RQTTXGQDIROLTQ-FLJXCGGLSA-M 		isovitexin 2''-O-beta-D-glucoside
(1S)-1,5-anhydro-2-O-D-glucopyranosyl-1-[5-hydroxy-2-(4-hydroxyphenyl)-7-oxido-4-oxo-4H-chromen-6-yl]-D-glucitol
isovitexin 2''-O-beta-D-glucoside(1-)

chebi:14483
chebi:24931
chebi:6071
keggC:M_C04199
seedM:M_cpd02579
vmhM:M_ivitxn2oglc 		secondary/obsolete/fantasy identifier