CAS RN: 108321-18-2
1,2-DISTEAROYL-SN-GLYCERO-3-PHOSPHATIDIC ACID, SODIUM SALT
Product Availability
Choose a grade to view its available package options.
7 package records7 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260301 | 25mg / 100mg / 500mg / 1g | Confirm by inquiry | Shanghai, Shandong, Hebei | Inquiry |
- Product code: starshine_CAS108321-18-2
- Purity/Analytical Methods: >99.0%
108321-18-2 / sodium [(2R)-2,3-di(octadecanoyloxy)propyl] hydrogen phosphate
1,2-Distearoyl-sn-glycero-3-phosphate sodium salt | 1,2-distearoyl-sn-glycero-3-phosphate (sodium salt)
Basic Information
CAS
108321-18-2
Multi CAS
Yes
Molecular Formula
C39H76NaO8P
Molecular Weight
727.000000
Exact Mass
726.517551
SMILES
CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)[O-])OC(=O)CCCCCCCCCCCCCCCCC.[Na+]
InChI
InChI=1S/C39H77O8P.Na/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(40)45-35-37(36-46-48(42,43)44)47-39(41)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;/h37H,3-36H2,1-2H3,(H2,42,43,44);/q;+1/p-1/t37-;/m1./s1
InChIKey
ALPWRKFXEOAUDR-GKEJWYBXSA-M
Synonyms
1,2-Distearoyl-sn-glycero-3-phosphate sodium salt
1,2-distearoyl-sn-glycero-3-phosphate (sodium salt)
Computed Properties
Structural Parameters
Heavy atom count
49
Fraction Csp3
0.95
Rotatable bonds
38
H-bond acceptors
7
H-bond donors
1
Molar refractivity
195.71
TPSA
122.19
LogP / Solubility
WLOGP
8.45
MLOGP
7.5
XLogP3
8.45
Consensus LogP
8.13
Log S (ESOL)
-7.16
Class (ESOL)
Insoluble
Log S (Ali)
-11.62
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-15.96
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)
-1.16
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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