(Q105150605)

English

(2S,3R,4S,5R)-2-[5,7-dihydroxy-2-(4-hydroxyphenyl)chromenylium-3-yl]oxyoxane-3,4,5-triol

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

Pelargonidin 3-arabinoside

1 reference

based on heuristic

inferred from SMILES

mass

403.10235860809 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₁₉O₉⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

OC=1C=CC(=CC1)C2=[O+]C=3C=C(O)C=C(O)C3C=C2OC4OCC(O)C(O)C4O

0 references

isomeric SMILES

Oc1ccc(-c2[o+]c3cc(O)cc(O)c3cc2O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)cc1

0 references

found in taxon

Tacca integrifolia

1 reference

stated in

Phytochemical Investigation of the roots of Tacca aspera

Tacca plantaginea

1 reference

stated in

Steroidal bitter principles from tacca plantaginea structures of taccalonolide A and B

Identifiers

InChI

InChI=1S/C20H18O9/c21-10-3-1-9(2-4-10)19-16(29-20-18(26)17(25)14(24)8-27-20)7-12-13(23)5-11(22)6-15(12)28-19/h1-7,14,17-18,20,24-26H,8H2,(H2-,21,22,23)/p+1/t14-,17+,18-,20+/m1/s1

0 references

InChIKey

LEJPLPFWLUXHCB-GBYFWLHCSA-O

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

LEJPLPFWLUXHCB-GBYFWLHCSA-O

1 reference

1 reference

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

retrieved

15 January 2022

InChIKey

LEJPLPFWLUXHCB-GBYFWLHCSA-O

(Q105150605)

(2S,3R,4S,5R)-2-[5,7-dihydroxy-2-(4-hydroxyphenyl)chromenylium-3-yl]oxyoxane-3,4,5-triol

Statements

Identifiers

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