(Q105208912)

English

[(2R,3S,4S,5S,6R)-6-[2,3-dihydroxy-5-(3,5,7-trihydroxy-4-oxochromen-2-yl)phenoxy]-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

[6-[2,3-Dihydroxy-5-(3,5,7-trihydroxy-4-oxochromen-2-yl)phenoxy]-3,4,5-trihydroxyoxan-2-yl]methyl 3-(4-hydroxyphenyl)prop-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

626.127170132 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(2R,3S,4S,5R,6S)-6-[2,3-dihydroxy-5-(3,5,7-trihydroxy-4-oxochromen-2-yl)phenoxy]-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₃₀H₂₆O₁₅

0 references

canonical SMILES

O=C(OCC1OC(OC=2C=C(C=C(O)C2O)C=3OC=4C=C(O)C=C(O)C4C(=O)C3O)C(O)C(O)C1O)C=CC5=CC=C(O)C=C5

0 references

isomeric SMILES

O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@H](Oc2cc(-c3oc4cc(O)cc(O)c4c(=O)c3O)cc(O)c2O)[C@@H](O)[C@@H](O)[C@@H]1O

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found in taxon

Nymphaea lotus

1 reference

stated in

Two very unusual macrocyclic flavonoids from the water lily Nymphaea lotus

Identifiers

InChI

InChI=1S/C30H26O15/c31-14-4-1-12(2-5-14)3-6-21(35)42-11-20-24(37)26(39)28(41)30(45-20)44-19-8-13(7-17(34)23(19)36)29-27(40)25(38)22-16(33)9-15(32)10-18(22)43-29/h1-10,20,24,26,28,30-34,36-37,39-41H,11H2/b6-3+/t20-,24-,26+,28+,30+/m1/s1

0 references

InChIKey

PHEXVBOYEBOWGX-TZQGOYCZSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105208912)

[(2R,3S,4S,5S,6R)-6-[2,3-dihydroxy-5-(3,5,7-trihydroxy-4-oxochromen-2-yl)phenoxy]-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate

Statements

Identifiers

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