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CHEBI:77809 - 7-O-methylvitexin 2''-O-α-L-rhamnoside(1−)

ChEBI IDCHEBI:77809
ChEBI Name7-O-methylvitexin 2''-O-α-L-rhamnoside(1−)
Stars
ASCII Name7-O-methylvitexin 2''-O-alpha-L-rhamnoside(1-)
DefinitionA flavonoid oxoanion obtained by deprotonation of the 5-hydroxy group of 7-O-methylvitexin 2''-O-α-L-rhamnoside. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
Last Modified4 June 2014
SubmitterAnne Morgat
DownloadsMolfile
FormulaC28H31O14
Net Charge-1
Average Mass591.542
Monoisotopic Mass591.17193
SMILESCOc1cc([O-])c2c(=O)cc(-c3ccc(O)cc3)oc2c1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O
InChIInChI=1S/C28H32O14/c1-10-20(33)22(35)24(37)28(39-10)42-27-23(36)21(34)17(9-29)41-26(27)19-16(38-2)8-14(32)18-13(31)7-15(40-25(18)19)11-3-5-12(30)6-4-11/h3-8,10,17,20-24,26-30,32-37H,9H2,1-2H3/p-1/t10-,17+,20-,21+,22+,23-,24+,26-,27+,28-/m0/s1
InChIKeyHFUYHHROXLKXRR-WBXLRLGPSA-M
ChEBI Ontology
Outgoing Relation(s)
7-O-methylvitexin 2''-O-α-L-rhamnoside(1−) (CHEBI:77809) is a flavonoid oxoanion (CHEBI:60038)
7-O-methylvitexin 2''-O-α-L-rhamnoside(1−) (CHEBI:77809) is conjugate base of 7-O-methylvitexin 2''-O-α-L-rhamnoside (CHEBI:31143)
Incoming Relation(s)
7-O-methylvitexin 2''-O-α-L-rhamnoside (CHEBI:31143) is conjugate acid of 7-O-methylvitexin 2''-O-α-L-rhamnoside(1−) (CHEBI:77809)
IUPAC Name 
(1S)-1,5-anhydro-2-O-(6-deoxy-α-L-mannopyranosyl)-1-[2-(4-hydroxyphenyl)-7-methoxy-5-oxido-4-oxo-4H-chromen-8-yl]-D-glucitol