(Q104391461)

English

Pelargonidin 3-sophoroside

group of stereoisomers with the chemical formula C₂₇H₃₁O₁₅⁺

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Statements

instance of

group of stereoisomers

0 references

1 reference

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595.16574671209 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₇H₃₁O₁₅⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

OC=1C=CC(=CC1)C2=[O+]C=3C=C(O)C=C(O)C3C=C2OC4OC(CO)C(O)C(O)C4OC5OC(CO)C(O)C(O)C5O

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isomeric SMILES

OCC1O[C@@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)cc2)C(O[C@@H]2OC(CO)[C@@H](O)C(O)[C@H]2O)C(O)[C@@H]1O

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found in taxon

Rubus idaeus

2 references

stated in

Storage Changes in Anthocyanin Content of Red Raspberry Juice Concentrate

stated in

Anthocyanin Composition of Red Raspberry Juice: Influences of Cultivar, Processing, and Environmental Factors

Ipomoea nil

1 reference

stated in

A Novel Acylated Pelargonidin 3-Sophoroside-5-glucoside from Greyish-Purple Flowers of the Japanese Morning Glory

Identifiers

InChI

InChI=1S/C27H30O15/c28-8-17-19(33)21(35)23(37)26(40-17)42-25-22(36)20(34)18(9-29)41-27(25)39-16-7-13-14(32)5-12(31)6-15(13)38-24(16)10-1-3-11(30)4-2-10/h1-7,17-23,25-29,33-37H,8-9H2,(H2-,30,31,32)/p+1/t17?,18?,19-,20-,21?,22?,23-,25?,26+,27-/m1/s1

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InChIKey

HASVPNDDKSXPGU-HYSOADAZSA-O

0 references

2 references

26 December 2021

matched by identifier from

InChIKey

HASVPNDDKSXPGU-HYSOADAZSA-O

1 reference

1 reference

HASVPNDDKSXPGU-HYSOADAZSA-O

17 April 2021

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

(Q104391461)

Pelargonidin 3-sophoroside

Statements

Identifiers

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