Mulbel-rochromene (Q105165455): Difference between revisions

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‎Added [uk] description: хімічна сполука, batch #96092
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‎Added reference to claim: PubChem CID (P662): 441780, batch #230733
 
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label / enlabel / en
(1R,9S,13S,21R)-1-(2,4-dihydroxyphenyl)-17-(6-hydroxy-1-benzofuran-2-yl)-11-methyl-2,20-dioxapentacyclo[11.7.1.0³,⁸.0⁹,²¹.0¹⁴,¹⁹]henicosa-3,5,7,11,14,16,18-heptaene-5,15-diol
Mulbel-rochromene
description / frdescription / fr
 
composé chimique
Property / instance of
 
Property / instance of: chemical compound / rank
Normal rank
 
Property / instance of
 
Property / instance of: biogenic benzofuran / rank
Normal rank
 
Property / instance of: biogenic benzofuran / reference
 
Property / instance of
 
Property / instance of: type of chemical entity / rank
 
Normal rank
Property / PubChem CID
 
Property / PubChem CID: 441780 / rank
 
Normal rank
Property / PubChem CID: 441780 / reference
 
stated in: PubChem
retrieved: 17 September 2022
Timestamp+2022-09-17T00:00:00Z
Timezone+00:00
CalendarGregorian
Precision1 day
Before0
After0

based on heuristic: inferred from InChIKey
Property / PubChem CID: 441780 / reference
 
Property / mass
 
562.162767792 dalton
Amount562.162767792 dalton
Unitdalton
Property / mass: 562.162767792 dalton / rank
 
Normal rank
Property / mass: 562.162767792 dalton / reference
 
Property / subclass of
 
Property / subclass of: 1-(2,4-Dihydroxyphenyl)-17-(6-hydroxy-1-benzofuran-2-yl)-11-methyl-2,20-dioxapentacyclo[11.7.1.03,8.09,21.014,19]henicosa-3(8),4,6,11,14,16,18-heptaene-5,15-diol / rank
 
Normal rank
Property / subclass of: 1-(2,4-Dihydroxyphenyl)-17-(6-hydroxy-1-benzofuran-2-yl)-11-methyl-2,20-dioxapentacyclo[11.7.1.03,8.09,21.014,19]henicosa-3(8),4,6,11,14,16,18-heptaene-5,15-diol / reference
 
Property / subclass of
 
Property / subclass of: SureCN14007024 / rank
 
Normal rank
Property / subclass of: SureCN14007024 / reference
 
Property / subclass of
 
Property / subclass of: (9R)-1-(2,4-dihydroxyphenyl)-17-(6-hydroxy-1-benzofuran-2-yl)-11-methyl-2,20-dioxapentacyclo[11.7.1.03,8.09,21.014,19]henicosa-3(8),4,6,11,14,16,18-heptaene-5,15-diol / rank
 
Normal rank
Property / subclass of: (9R)-1-(2,4-dihydroxyphenyl)-17-(6-hydroxy-1-benzofuran-2-yl)-11-methyl-2,20-dioxapentacyclo[11.7.1.03,8.09,21.014,19]henicosa-3(8),4,6,11,14,16,18-heptaene-5,15-diol / reference
 
Property / UniChem compound ID
 
Property / UniChem compound ID: 28776587 / rank
 
Normal rank
Property / UniChem compound ID: 28776587 / reference
 
Property / stereoisomer of
 
Property / stereoisomer of: albanol A / rank
 
Normal rank
Property / stereoisomer of: albanol A / reference
 
Property / stereoisomer of: albanol A / reference
 
Property / stereoisomer of
 
Property / stereoisomer of: mulberrofuran G / rank
 
Normal rank
Property / stereoisomer of: mulberrofuran G / reference
 
Property / stereoisomer of: mulberrofuran G / reference
 
Property / stereoisomer of
 
Property / stereoisomer of: (1S,9S,13R,21R)-1-(2,4-dihydroxyphenyl)-17-(6-hydroxy-1-benzofuran-2-yl)-11-methyl-2,20-dioxapentacyclo[11.7.1.03,8.09,21.014,19]henicosa-3(8),4,6,11,14,16,18-heptaene-5,15-diol / rank
 
Normal rank
Property / stereoisomer of: (1S,9S,13R,21R)-1-(2,4-dihydroxyphenyl)-17-(6-hydroxy-1-benzofuran-2-yl)-11-methyl-2,20-dioxapentacyclo[11.7.1.03,8.09,21.014,19]henicosa-3(8),4,6,11,14,16,18-heptaene-5,15-diol / reference
 
Property / stereoisomer of: (1S,9S,13R,21R)-1-(2,4-dihydroxyphenyl)-17-(6-hydroxy-1-benzofuran-2-yl)-11-methyl-2,20-dioxapentacyclo[11.7.1.03,8.09,21.014,19]henicosa-3(8),4,6,11,14,16,18-heptaene-5,15-diol / reference
 
Property / UNII
 
Property / UNII: 39PXQ8D28J / rank
 
Normal rank
Property / UNII: 39PXQ8D28J / reference
 

Latest revision as of 20:13, 24 May 2024

chemical compound
Language Label Description Also known as
English
Mulbel-rochromene
chemical compound

    Statements

    mass
    562.162767792 dalton
    1 reference
    based on heuristic
    inferred from SMILES
    chemical formula
    C₃₄H₂₆O₈
    0 references
    canonical SMILES
    OC1=CC=C(C(O)=C1)C23OC4=CC(O)=CC=C4C5CC(=CC(C6=C(O)C=C(C=C6O2)C=7OC=8C=C(O)C=CC8C7)C53)C
    0 references
    isomeric SMILES
    CC1=C[C@@H]2c3c(O)cc(-c4cc5ccc(O)cc5o4)cc3O[C@]3(c4ccc(O)cc4O)Oc4cc(O)ccc4[C@@H](C1)[C@H]23
    0 references

    Identifiers

     
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