CAS RN: 76060-35-0
1-Dehydro-6-gingerdione
Product Availability
Choose a grade to view its available package options.
6 package records5 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250831 | 5mg | Out of stock | 30 business days | Inquiry |
- Product code: starshine_CAS76060-35-0
- Purity/Analytical Methods: >99.0%
76060-35-0 / (E)-1-(4-hydroxy-3-methoxyphenyl)dec-1-ene-3,5-dione
Basic Information
CAS
76060-35-0
Multi CAS
Yes
Molecular Formula
C17H22O4
Molecular Weight
290.400000
Exact Mass
290.151809
InChI
InChI=1S/C17H22O4/c1-3-4-5-6-14(18)12-15(19)9-7-13-8-10-16(20)17(11-13)21-2/h7-11,20H,3-6,12H2,1-2H3/b9-7+
InChIKey
JUKHKHMSQCQHEN-VQHVLOKHSA-N
Computed Properties
Structural Parameters
Heavy atom count
21
Aromatic heavy atom count
6
Fraction Csp3
0.41
Rotatable bonds
9
H-bond acceptors
4
H-bond donors
1
Molar refractivity
82.47
TPSA
63.6
LogP / Solubility
WLOGP
3.52
MLOGP
3.11
XLogP3
3.5
Consensus LogP
3.38
Log S (ESOL)
-3.48
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.48
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.55
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.99
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
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