(Q105245641)

English

26-({16,25-dihydroxy-14-oxapentacyclo[20.2.2.2¹⁰,¹³.1¹⁵,¹⁹.0²,⁷]nonacosa-1(24),2,4,6,10,12,15(27),16,18,22,25,28-dodecaen-5-yl}oxy)-14-oxapentacyclo[20.2.2.2¹⁰,¹³.1¹⁵,¹⁹.0²,⁷]nonacosa-1(24),2,4,6,10,12,15(27),16,18,22,25,28-dodecaene-5,16,24-triol

chemical compound

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instance of

type of chemical entity

0 references

subclass of

chemical compound

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mass

846.319268432 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₅₆H₄₆O₈

0 references

canonical SMILES

OC1=CC=C2C3=CC(OC4=CC=C5C6=CC=C(C=C6O)CCC7=CC=C(O)C(OC8=CC=C(C=C8)CCC5=C4)=C7)=C(C=C3O)CCC9=CC=C(O)C(OC%10=CC=C(C=C%10)CCC2=C1)=C9

0 references

found in taxon

Blasia pusilla

2 references

stated in

Phenolic constituents of the liverwort: Four novel cyclic bisbibenzyl dimers from Blasia pusilla L

stated in

Structures of four novel macrocyclic bis(bibenzyl) dimers, pusilatins A–D from the liverwort Blasia pusilla

Identifiers

InChI

InChI=1S/C56H46O8/c57-42-16-23-47-39(30-42)13-3-34-6-17-44(18-7-34)63-56-29-38(12-26-51(56)59)5-15-41-32-53(61)49(47)33-54(41)64-45-21-24-46-40(31-45)14-4-35-8-19-43(20-9-35)62-55-28-37(11-25-50(55)58)2-1-36-10-22-48(46)52(60)27-36/h6-12,16-33,57-61H,1-5,13-15H2

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InChIKey

RUJCFHBRBGIGNO-UHFFFAOYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

RUJCFHBRBGIGNO-UHFFFAOYSA-N

(Q105245641)

26-({16,25-dihydroxy-14-oxapentacyclo[20.2.2.2¹⁰,¹³.1¹⁵,¹⁹.0²,⁷]nonacosa-1(24),2,4,6,10,12,15(27),16,18,22,25,28-dodecaen-5-yl}oxy)-14-oxapentacyclo[20.2.2.2¹⁰,¹³.1¹⁵,¹⁹.0²,⁷]nonacosa-1(24),2,4,6,10,12,15(27),16,18,22,25,28-dodecaene-5,16,24-triol

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Identifiers

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