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vitexin 2''-O-beta-L-rhamnoside

PropertiesImage
MNX_IDMNXM726908 Image of MNXM726908
referencechebi:78636
formulaC27H29O14
global charge-1
mol weight577.515
InChIKeyLYGPBZVKGHHTIE-JZUNINQASA-M
InChIInChI=1S/C27H30O14/c1-9-19(33)21(35)23(37)27(38-9)41-26-22(36)20(34)16(8-28)40-25(26)18-13(31)6-12(30)17-14(32)7-15(39-24(17)18)10-2-4-11(29)5-3-10/h2-7,9,16,19-23,25-31,33-37H,8H2,1H3/p-1/t9-,16+,19-,20+,21+,22-,23+,25-,26+,27+/m0/s1
SMILESC[C@@H]1O[C@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2C2=C3OC(C4=CC=C(O)C=C4)=CC(=O)C3=C(O)C=C2[O-])[C@H](O)[C@H](O)[C@H]1O
MNX internals
InChI (mnx)InChI=1/C27H30O14/c1-9-19(33)21(35)23(37)27(38-9)41-26-22(36)20(34)16(8-28)40-25(26)18-13(31)6-12(30)17-14(32)7-15(39-24(17)18)10-2-4-11(29)5-3-10/h2-7,9,16,19-23,25-31,33-37H,8H2,1H3/t9-,16+,19-,20+,21+,22-,23+,25-,26+,27+/m0/s1 Image of MNXM726908
SMILES (mnx)[CH3:1][C@H:9]1[C@H:19]([OH:33])[C@@H:21]([OH:35])[C@@H:23]([OH:37])[C@@H:27]([O:41][C@@H:26]2[C@@H:22]([OH:36])[C@H:20]([OH:34])[C@@H:16]([CH2:8][OH:28])[O:40][C@H:25]2[C:18]2=[C:13]([OH:31])[CH:6]=[C:12]([OH:30])[C:17]3=[C:24]2[O:39][C:15]([C:10]2=[CH:3][CH:5]=[C:11]([OH:29])[CH:4]=[CH:2]2)=[CH:7][C:14]3=[O:32])[O:38]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:78636
chebi:78636
LYGPBZVKGHHTIE-JZUNINQASA-M 		vitexin 2''-O-beta-L-rhamnoside
(1S)-1,5-anhydro-2-O-(6-deoxy-beta-L-mannopyranosyl)-1-[5-hydroxy-2-(4-hydroxyphenyl)-7-oxido-4-oxo-4H-chromen-8-yl]-D-glucitol
vitexin 2''-O-beta-L-rhamnoside(1-)

seed.compound:cpd09259
seedM:cpd09259
LYGPBZVKGHHTIE-JZUNINQASA-M 		Vitexin 2''-rhamnoside
(1S)-1,5-anhydro-2-O-(6-deoxy--L-mannopyranosyl)-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-D-glucitol
2''-O-Rhamnosylvitexin
Apigenin-8-C-glucoside-2'-rhamnoside
Vitexin 2''-O-beta-L-rhamnoside
vitexin 2''-O-beta-L-rhamnoside

metacyc.compound:VITEXIN-2-O-B-L-RHAMNOSIDE
metacycM:VITEXIN-2-O-B-L-RHAMNOSIDE
LYGPBZVKGHHTIE-JZUNINQASA-M 		vitexin 2''-O-beta-L-rhamnoside
(1S)-1,5-anhydro-2-O-(6-deoxy--L-mannopyranosyl)-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-D-glucitol
2''-O-Rhamnosylvitexin
Apigenin-8-C-glucoside-2'-rhamnoside
Vitexin 2''-rhamnoside

CHEBI:82682
chebi:82682
LYGPBZVKGHHTIE-JZUNINQASA-N 		vitexin 2''-O-beta-L-rhamnoside
(1S)-1,5-anhydro-2-O-(6-deoxy-beta-L-mannopyranosyl)-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-D-glucitol
(1S)-1,5-anhydro-2-O-(beta-L-rhamnopyranosyl)-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-D-glucitol
2''-O-Rhamnosylvitexin
Vitexin 2''-rhamnoside

seedM:M_cpd09259 		secondary/obsolete/fantasy identifier