(Q105127949)

English

Isolicopyranocoumarin

group of stereoisomers with the chemical formula C₂₁H₂₀O₇

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Statements

instance of

group of stereoisomers

0 references

subclass of

6C-prenylarylcoumarin

1 reference

inferred from

6C-prenylarylcoumarin

6C-substituted 3-phenylcoumarin

1 reference

inferred from

6C-substituted 3-phenylcoumarin

mass

384.12090298 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₂₀O₇

0 references

canonical SMILES

O=C1OC=2C=C3OC(C)(C)C(O)CC3=C(OC)C2C=C1C=4C=CC(O)=CC4O

0 references

found in taxon

Glycyrrhiza uralensis

2 references

stated in

Phenolic Constituents of Liquorice. VII. A New Chalcone with a Potent Radical Scavenging Activity and Accompanying Phenolics from Liquorice.

stated in

Phenolic constituents of licorice. VIII. Structures of glicophenone and glicoisoflavanone, and effects of licorice phenolics on methicillin-resistant Staphylococcus aureus

Identifiers

InChI

InChI=1S/C21H20O7/c1-21(2)18(24)8-14-17(28-21)9-16-13(19(14)26-3)7-12(20(25)27-16)11-5-4-10(22)6-15(11)23/h4-7,9,18,22-24H,8H2,1-3H3

0 references

InChIKey

JHGBGRLHQJNGPN-UHFFFAOYSA-N

0 references

CAS Registry Number

197303-94-9

1 reference

stated in

CAS (formerly Chemical Abstracts Service)

25 January 2022

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

JHGBGRLHQJNGPN-UHFFFAOYSA-N

ChEBI ID

175894

mapping relation type

exact match

2 references

stated in

ChEBI release 2022-06-13

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C21H20O7/c1-21(2)18(24)8-14-17(28-21)9-16-13(19(14)26-3)7-12(20(25)27-16)11-5-4-10(22)6-15(11)23/h4-7,9,18,22-24H,8H2,1-3H3

1 reference

1 reference

matched by identifier from

InChIKey

JHGBGRLHQJNGPN-UHFFFAOYSA-N

Human Metabolome Database ID

HMDB0035479

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

JHGBGRLHQJNGPN-UHFFFAOYSA-N

KNApSAcK ID

C00060647

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

JHGBGRLHQJNGPN-UHFFFAOYSA-N

(Q105127949)

Isolicopyranocoumarin

Statements

Identifiers

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