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CAS 69254-37-1 5Z,8Z,11Z,14Z-EICOSATETRAENOIC-5,6,8,9,11,12,14,15-D8 ACID molecular structure lightbox
CAS RN: 69254-37-1

5Z,8Z,11Z,14Z-EICOSATETRAENOIC-5,6,8,9,11,12,14,15-D8 ACID

Product Availability

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3 package records2 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250626 5mg Out of stock 5-7 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250621 1mg In stock Shanghai, Hebei Inquiry
Batchno.20250809 5mg In stock Shanghai Inquiry
  • Product code: starshine_CAS69254-37-1
  • Purity/Analytical Methods: >99.0%
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69254-37-1 / icosa-5,8,11,14-tetraenoic acid

Standard CAS: 69254-37-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
69254-37-1
Multi CAS
Yes
Molecular Formula
C20H32O2
Molecular Weight
304.500000
Exact Mass
304.240230
InChI
InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-,16-15-/i6D,7D,9D,10D,12D,13D,15D,16D
InChIKey
YZXBAPSDXZZRGB-FBFLGLDDSA-N

Computed Properties

Structural Parameters

Heavy atom count
22
Fraction Csp3
0.55
Rotatable bonds
14
H-bond acceptors
1
H-bond donors
1
Molar refractivity
96.04
TPSA
37.3

LogP / Solubility

WLOGP
6.22
MLOGP
5.48
XLogP3
6.3
Consensus LogP
6
Log S (ESOL)
-4.72
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.55
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.48
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.16

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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