CAS RN: 86288-11-1
1-O-HEXADECYL-2-ARACHIDONYL-SN-GLYCERO-3-PHOSPHOCHOLINE
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.20260527 | 5mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS86288-11-1
- Purity/Analytical Methods: >99.0%
86288-11-1 / (3-hexadecoxy-2-icosa-5,8,11,14-tetraenoyloxypropyl) 2-(trimethylazaniumyl)ethyl phosphate
Basic Information
CAS
86288-11-1
Multi CAS
Yes
Molecular Formula
C44H82NO7P
Molecular Weight
768.100000
Exact Mass
767.582891
InChI
InChI=1S/C44H82NO7P/c1-6-8-10-12-14-16-18-20-22-23-24-25-27-29-31-33-35-37-44(46)52-43(42-51-53(47,48)50-40-38-45(3,4)5)41-49-39-36-34-32-30-28-26-21-19-17-15-13-11-9-7-2/h14,16,20,22,24-25,29,31,43H,6-13,15,17-19,21,23,26-28,30,32-42H2,1-5H3/b16-14-,22-20-,25-24-,31-29-/t43-/m1/s1
InChIKey
DUUSFCFZBREELS-WWBBCYQPSA-N
Computed Properties
Structural Parameters
Heavy atom count
53
Fraction Csp3
0.8
Rotatable bonds
39
H-bond acceptors
7
Molar refractivity
221.82
TPSA
94.12
LogP / Solubility
WLOGP
11.75
MLOGP
10.41
XLogP3
13
Consensus LogP
11.72
Log S (ESOL)
-9.43
Class (ESOL)
Insoluble
Log S (Ali)
-14.34
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-19.08
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
0.94
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5
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