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CAS 51779-95-4 1,2-Dierucoyl-sn-glycero-3-phosphocholine molecular structure lightbox
CAS RN: 51779-95-4

1,2-Dierucoyl-sn-glycero-3-phosphocholine

Product Availability

Choose a grade to view its available package options.

10 package records8 with current stock4 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250327 100mg Out of stock Inquiry
Batchno.20260502 25mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250425 100mg In stock Inquiry
Batchno.20250210 25mg In stock Inquiry
Batchno.20250511 500mg In stock Inquiry
Batchno.20250820 50mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250326 1g Out of stock 8-10 business days Inquiry
Batchno.20250712 250mg In stock Chongqing Inquiry
Batchno.20251031 50mg In stock Shanghai, Shandong Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251205 50mg / 250mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-158726
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 0.25g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 51779-95-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Shanghai Inquiry

51779-95-4 / [(2R)-2,3-bis[[(E)-docos-13-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate

Standard CAS: 51779-95-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
51779-95-4
Multi CAS
Yes
Molecular Formula
C52H100NO8P
Molecular Weight
898.300000
Exact Mass
897.718656
InChI
InChI=1S/C52H100NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-42-44-51(54)58-48-50(49-60-62(56,57)59-47-46-53(3,4)5)61-52(55)45-43-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20-23,50H,6-19,24-49H2,1-5H3/b22-20+,23-21+/t50-/m1/s1
InChIKey
SDEURMLKLAEUAY-QVOKQPLLSA-N

Computed Properties

Structural Parameters

Heavy atom count
62
Fraction Csp3
0.88
Rotatable bonds
48
H-bond acceptors
8
Molar refractivity
259.09
TPSA
111.19

LogP / Solubility

WLOGP
14.84
MLOGP
13.15
XLogP3
18.1
Consensus LogP
15.36
Log S (ESOL)
-11.59
Class (ESOL)
Insoluble
Log S (Ali)
-17.64
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-23.58
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)
2.34

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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