[email protected]
CAS 108392-02-5 1,2-DI[CIS-9-OCTADECENOYL]-SN-GLYCERO-3-PHOSPHATE SODIUM SALT molecular structure lightbox
CAS RN: 108392-02-5

1,2-DI[CIS-9-OCTADECENOYL]-SN-GLYCERO-3-PHOSPHATE SODIUM SALT

Product Availability

Choose a grade to view its available package options.

14 package records14 with current stock4 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250529 100mg In stock Shanghai, Shandong, Guangdong, Hebei Inquiry
Batchno.20260429 1g In stock Shanghai, Shandong, Guangdong Inquiry
Batchno.20260219 25mg In stock Shanghai, Shandong, Guangdong, Chongqing Inquiry
Batchno.20250302 500mg In stock Shandong, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251202 100mg In stock Inquiry
Batchno.20251129 1g In stock Inquiry
Batchno.20250125 25mg In stock Inquiry
Batchno.20260426 500mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250322 25mg In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260224 100mg In stock Shanghai, Shenzhen Inquiry
Batchno.20260414 1g In stock Shanghai Inquiry
Batchno.20260120 250mg In stock Shanghai, Tianjin Inquiry
Batchno.20251031 50mg In stock Shanghai Inquiry
Batchno.20250122 5g In stock Shanghai Inquiry
  • Product code: starshine_CAS108392-02-5
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

108392-02-5 / 1,2-DI[CIS-9-OCTADECENOYL]-SN-GLYCERO-3-PHOSPHATE SODIUM SALT

PA(18:1(9Z)/18:1(9Z)) | RefChem:1094250 | ((2R)-2,3-bis((9Z)-octadec-9-enoyloxy)propoxy)phosphonic acid

Standard CAS: 108392-02-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
108392-02-5
Multi CAS
Yes
Molecular Formula
C39H73NaO8P
Molecular Weight
724.000000
Exact Mass
723.494076
SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)O)OC(=O)CCCCCCC/C=C\CCCCCCCC.[Na]
InChI
InChI=1S/C39H73O8P.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;/h17-20,37H,3-16,21-36H2,1-2H3,(H2,42,43,44);/b19-17+,20-18+;
InChIKey
KHDHADSEKGCPKW-ZGWGUCJNSA-N
Synonyms
PA(18:1(9Z)/18:1(9Z)) RefChem:1094250 ((2R)-2,3-bis((9Z)-octadec-9-enoyloxy)propoxy)phosphonic acid 1,2-dioleoyl-sn-glycerol-3-phosphate 1,2-di-(9Z-octadecenoyl)-sn-glycero-3-phosphate

Computed Properties

Structural Parameters

Heavy atom count
49
Fraction Csp3
0.85
Rotatable bonds
36
H-bond acceptors
6
H-bond donors
2
Molar refractivity
203.49
TPSA
119.36

LogP / Solubility

WLOGP
11.24
MLOGP
9.96
XLogP3
11.24
Consensus LogP
10.81
Log S (ESOL)
-9.04
Class (ESOL)
Insoluble
Log S (Ali)
-13.62
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-18.02
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)
0.85

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
4.5

Customers Also Viewed

Get In Touch

Contact Us