| General Information of the NP (ID: NP0858) |
| Name |
Fraxetin
|
| Synonyms |
Fraxetin
574-84-5
7,8-Dihydroxy-6-methoxycoumarin
7,8-Dihydroxy-6-methoxy-2H-chromen-2-one
7,8-dihydroxy-6-methoxychromen-2-one
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| Species Origin |
Fraxinus rhynchophylla ...
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| Fraxinus rhynchophylla |
SuperKingdom: Eukaryota
Kingdom: Viridiplantae
Phylum: Tracheophyta
Class: Magnoliopsida
Order: Lamiales
Family: Oleaceae
Genus: Fraxinus
Species: Fraxinus rhynchophylla
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| Disease |
Adenocarcinoma of pancreas
[ICD-11: 2C10.0] |
Investigative |
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| Structure |
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2D MOL
3D MOL
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| ADMET Property |
Absporption
Caco-2 Permeability
-5.135
MDCK Permeability
-4.78
Distribution
Metabolism
CYP1A2 inhibitor
+++
CYP1A2 substrate
- - -
CYP2C19 inhibitor
- - -
CYP2C19 substrate
- - -
CYP2C9 inhibitor
- - -
CYP2C9 substrate
+++
CYP2D6 inhibitor
- -
CYP2D6 substrate
- - -
CYP3A4 inhibitor
- - -
CYP3A4 substrate
- - -
CYP2B6 inhibitor
- - -
CYP2B6 substrate
- - -
CYP2C8 inhibitor
- - -
HLM Stability
- -
Excretion
CLplasma
11.302
T1/2
1.536
Toxicity
DILI
++
Rat Oral Acute Toxicity
-
Human Hepatotoxicity
-
Ototoxicity
- -
Drug-induced Nephrotoxicity
- -
Drug-induced Neurotoxicity
- -
Hematotoxicity
- -
Genotoxicity
++
Tips: 1. For the classification endpoints, the prediction probability values are transformed into six symbols: 0-0.1 (- - -), 0.1-0.3 (- -), 0.3-0.5 (-), 0.5-0.7 (+), 0.7-0.9 (++), and 0.9-1.0 (+++).
2. Additionally, the corresponding relationships of the three labels are as follows: excellent; medium; poor.
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Click to Show/Hide the Molecular Information and External Link(s) of This Natural Product
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| Formula |
C10H8O5
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| PubChem CID |
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| Canonical SMILES |
COC1=C(C(=C2C(=C1)C=CC(=O)O2)O)O
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| InChI |
InChI=1S/C10H8O5/c1-14-6-4-5-2-3-7(11)15-10(5)9(13)8(6)12/h2-4,12-13H,1H3
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| InChIKey |
HAVWRBANWNTOJX-UHFFFAOYSA-N
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| CAS Number |
574-84-5
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| ChEBI ID |
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| Herb ID |
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| SymMap ID |
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| TCMSP ID |
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