CAS RN: 88378-59-0
ACTINOPYRONE A
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250225 | 500μg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS88378-59-0
- Purity/Analytical Methods: >99.0%
88378-59-0 / 2-(10-hydroxy-3,7,9,11-tetramethyltrideca-2,5,7,11-tetraenyl)-6-methoxy-3,5-dimethylpyran-4-one
Basic Information
CAS
88378-59-0
Multi CAS
Yes
Molecular Formula
C25H36O4
Molecular Weight
400.500000
Exact Mass
400.261360
InChI
InChI=1S/C25H36O4/c1-9-18(4)23(26)19(5)15-17(3)12-10-11-16(2)13-14-22-20(6)24(27)21(7)25(28-8)29-22/h9-10,12-13,15,19,23,26H,11,14H2,1-8H3
InChIKey
PFVSUJLJFXJPMF-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
29
Aromatic heavy atom count
6
Fraction Csp3
0.48
Rotatable bonds
9
H-bond acceptors
4
H-bond donors
1
Molar refractivity
120.58
TPSA
59.67
LogP / Solubility
WLOGP
5.61
MLOGP
4.96
XLogP3
6.3
Consensus LogP
5.62
Log S (ESOL)
-5.42
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.89
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.18
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3.5
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