Compound Summary
Compound Information
Esculetin
Compound Name: | Esculetin |
Compound CID: | 5281416 |
Synonyms: | Esculetin 305-01-1 6,7-DIHYDROXYCOUMARIN Aesculetin 6,7-Dihydroxy-2H-chromen-2-one More... |
Iupac Name: | 6,7-dihydroxychromen-2-one |
InChI: | InChI=1S/C9H6O4/c10-6-3-5-1-2-9(12)13-8(5)4-7(6)11/h1-4,10-11H |
InChIKey: | ILEDWLMCKZNDJK-UHFFFAOYSA-N |
Canonical Smiles: | C1=CC(=O)OC2=CC(=C(C=C21)O)O |
Isomeric Smiles: | C1=CC(=O)OC2=CC(=C(C=C21)O)O |
Molecular Weight: | 178.14 |
Molecular Formula: | C9H6O4 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Esculetin
Molecular Weight: | 178.14 |
Molecular Formula: | C9H6O4 |
Hydrogen Bond Donor Count: | 2 |
Hydrogen Bond Acceptor Count: | 4 |
Rotatable Bond Count: | 0 |
Heavy Atom Count: | 13 |
Complexity: | 248 |
Synonyms
Esculetin
| Esculetin | Esculetin |
|---|---|
Esculetin |
305-01-1 |
6,7-DIHYDROXYCOUMARIN |
Aesculetin |
6,7-Dihydroxy-2H-chromen-2-one |
Cichorigenin |
Esculetol |
Cichoriin aglucon |
Esculatin |
Esculin aglucon |
Esculin aglycon |
Cichoriin aglycon |
Asculetine |
2H-1-Benzopyran-2-one, 6,7-dihydroxy- |
6,7-dihydroxychromen-2-one |
6,7-Dihydroxy-2-benzopyrone |
6,7-Dihydroxy-2H-1-benzopyran-2-one |
Coumarin, 6,7-dihydroxy- |
UNII-SM2XD6V944 |
NSC 26428 |
6,7-bis(oxidanyl)chromen-2-one |
MFCD00006874 |
MLS000069479 |
CHEMBL244743 |
SM2XD6V944 |
CHEBI:490095 |
6,7-dihydroxy-1-benzopyran-2-one |
NSC26428 |
91753-33-2 |
SMR000059055 |
2H-1-Benzopyran-2-one, 6,7-dihydroxy- (9CI) |
esculetine |
CCRIS 7065 |
EINECS 206-161-5 |
BRN 0152788 |
Esculetol) |
Aesculetin ,(S) |
ACMC-20luwt |
Cichorigenin|Aesculetin |
Spectrum_001166 |
6,7-Dihydroxycounmarin |
Aesculetin (cichorigenin |
6,7-dihydroxy-coumarin |
SpecPlus_000334 |
7H-1-Benzopyran-7-one, 2,6-dihydroxy- |
Prestwick0_000940 |
Prestwick1_000940 |
Prestwick2_000940 |
Prestwick3_000940 |
Spectrum2_000586 |
Spectrum3_000752 |
Spectrum4_001886 |
Spectrum5_000512 |
bmse000986 |
Oprea1_719746 |
SCHEMBL24641 |
6,7-Dihydroxy-2-chromenone |
BSPBio_000880 |
BSPBio_002364 |
KBioGR_002416 |
KBioSS_001646 |
5-18-03-00202 (Beilstein Handbook Reference) |
6,7-Dihydroxycoumarin, 8CI |
DivK1c_006430 |
Esculetin, analytical standard |
SPECTRUM1500899 |
SPBio_000432 |
SPBio_003049 |
6,7-Dihydroxycoumarin, 98% |
BPBio1_000968 |
GTPL5180 |
DTXSID3075383 |
BDBM34571 |
cid_5281416 |
KBio1_001374 |
KBio2_001646 |
KBio2_004214 |
KBio2_006782 |
KBio3_001584 |
ZINC57908 |
HMS1570L22 |
HMS1921M14 |
HMS2097L22 |
HMS2233G24 |
HMS3373K09 |
KUC108669N |
2,6-Dihydroxy-7H-chromen-7-one |
ALBB-023362 |
AMY25634 |
HY-N0284 |
Coumarin, 6,7-dihydroxy- Esculetin |
BBL037229 |
CCG-38509 |
CE0046 |
NSC-26428 |
s4711 |
STL560155 |
6,7-Dihydroxy-2H-chromen-2-one # |
AKOS000276955 |
EBD2197580 |
MCULE-4460039316 |
SDCCGMLS-0066669.P001 |
SMP2_000093 |
NCGC00016425-01 |
NCGC00016425-02 |
NCGC00016425-03 |
NCGC00016425-04 |
NCGC00016425-05 |
NCGC00016425-06 |
NCGC00094873-01 |
NCGC00094873-02 |
AC-18400 |
AC-34573 |
AS-11863 |
CAS-305-01-1 |
KSC-11-243-1 |
NCI60_002119 |
ST079379 |
SY036794 |
AB0010898 |
DB-014626 |
AB00489955 |
CS-0008780 |
E0386 |
FT-0620854 |
N1764 |
A14553 |
C09263 |
E-3400 |
E-3401 |
J10146 |
O11524 |
305E011 |
A820407 |
SR-01000721907 |
Q3058018 |
SR-01000721907-2 |
BRD-K58149231-001-06-9 |
BRD-K58149231-001-10-1 |
Esculetin, European Pharmacopoeia (EP) Reference Standard |
HFC |
Experimental Data
Esculetin
| Species | Dosage | Unit | CG Lifespan(AVG/MED days) | TG Lifespan(AVG/MED days) | Lifespan Change(AVG/MED%) | CG Lifespan(MAX days) | TG Lifespan(MAX days) | Lifespan Change(MAX%) | Significant | Strain | Gender | PubMed | Active Label |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Lutzomyia longipalpis | 5.6 | mM | 17 | 22 | 29 | S | MALES | 30501613 | Active | ||||
| Lutzomyia longipalpis | 5.6 | mM | 15 | 15 | 0 | NS | FEMALES | 30501613 | Inactive |
Experimental Data Visualization
Esculetin
Statistics Data
Esculetin
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Lutzomyia longipalpis | 29 | 1 | 2 |
Statistics Data Visualization
Esculetin
