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CHEBI:144436 - petiolaroside(1−)

ChEBI IDCHEBI:144436
ChEBI Namepetiolaroside(1−)
Stars
ASCII Namepetiolaroside(1-)
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC27H29O16
Net Charge-1
Average Mass609.513
Monoisotopic Mass609.14611
SMILESC[C@@H]1O[C@@H](Oc2cc([O-])c3c(=O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(39-8)40-10-5-13(31)16-14(6-10)41-24(9-2-3-11(29)12(30)4-9)25(19(16)34)43-27-23(38)21(36)18(33)15(7-28)42-27/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/p-1/t8-,15+,17-,18+,20+,21-,22+,23+,26-,27-/m0/s1
InChIKeyOTUCXMIQUNROBJ-JFNZIVIESA-M
ChEBI Ontology
Outgoing Relation(s)
petiolaroside(1−) (CHEBI:144436) is a flavonoid oxoanion (CHEBI:60038)
petiolaroside(1−) (CHEBI:144436) is conjugate base of petiolaroside (CHEBI:67931)
Incoming Relation(s)
petiolaroside (CHEBI:67931) is conjugate acid of petiolaroside(1−) (CHEBI:144436)
UniProt Name  Source
quercetin 3-O-β-D-glucoside-7-O-α-L-rhamnosideUniProt