CAS RN: 10015-88-0
1-palmitoyl-2-oleoylphosphatidylethanolamine
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250321 | 1mg / 5mg / 25mg | Confirm by inquiry | Shanghai, Shandong | Inquiry |
- Product code: starshine_CAS10015-88-0
- Purity/Analytical Methods: >99.0%
10015-88-0 / [1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-hexadecanoyloxypropan-2-yl] (Z)-octadec-9-enoate
2-Oleoyl-1-palmitoyl-sn-glycero-3-phosphoethanolamine | PD197835
Basic Information
CAS
10015-88-0
Multi CAS
Yes
Molecular Formula
C39H76NO8P
Molecular Weight
718.000000
Exact Mass
717.530855
SMILES
CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCN)OC(=O)CCCCCCC/C=C\CCCCCCCC
InChI
InChI=1S/C39H76NO8P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-39(42)48-37(36-47-49(43,44)46-34-33-40)35-45-38(41)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h17-18,37H,3-16,19-36,40H2,1-2H3,(H,43,44)/b18-17-
InChIKey
FHQVHHIBKUMWTI-ZCXUNETKSA-N
Synonyms
2-Oleoyl-1-palmitoyl-sn-glycero-3-phosphoethanolamine
PD197835
Computed Properties
Structural Parameters
Heavy atom count
49
Fraction Csp3
0.9
Rotatable bonds
38
H-bond acceptors
8
H-bond donors
2
Molar refractivity
201.39
TPSA
134.38
LogP / Solubility
WLOGP
11.05
MLOGP
9.79
XLogP3
10.4
Consensus LogP
10.41
Log S (ESOL)
-8.75
Class (ESOL)
Insoluble
Log S (Ali)
-13.43
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-18.06
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
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
0.75
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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- Product Code: starshine_CAS10018-78-7
- Purity/Analytical method: >99.0%
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