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CAS 26662-94-2 1-HEXADECANOYL-2-[CIS-9-OCTADECENOYL]-SN-GLYCERO-3-PHOSPHOETHANOLAMINE molecular structure lightbox
CAS RN: 26662-94-2

1-HEXADECANOYL-2-[CIS-9-OCTADECENOYL]-SN-GLYCERO-3-PHOSPHOETHANOLAMINE

Product Availability

Choose a grade to view its available package options.

6 package records6 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250710 100mg In stock Shanghai Inquiry
Batchno.20251228 10mg In stock Shanghai Inquiry
Batchno.20250213 1g In stock Shanghai Inquiry
Batchno.20250920 250mg In stock Shanghai Inquiry
Batchno.20260508 50mg In stock Shanghai Inquiry
Batchno.20250315 5mg In stock Shanghai Inquiry
  • Product code: SSC-124746
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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 26662-94-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Beijing Inquiry

26662-94-2 / [1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-hexadecanoyloxypropan-2-yl] octadec-9-enoate

Standard CAS: 26662-94-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
26662-94-2
Multi CAS
No
Molecular Formula
C39H76NO8P
Molecular Weight
718.000000
Exact Mass
717.530855
SMILES
CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCN)OC(=O)CCCCCCCC=CCCCCCCCC
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-/t37-/m1/s1
InChIKey
FHQVHHIBKUMWTI-OTMQOFQLSA-N

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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