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CAS 73466-12-3 (-)-LEUKOTRIENE A4 METHYL ESTER molecular structure lightbox
CAS RN: 73466-12-3

(-)-LEUKOTRIENE A4 METHYL ESTER

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3 package records1 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250620 100μg Out of stock 30 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250820 25μg In stock Shanghai Inquiry
Batchno.20250523 50μg Out of stock 30 business days Inquiry
  • Product code: starshine_CAS73466-12-3
  • Purity/Analytical Methods: >99.0%
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73466-12-3 / methyl 4-(3-tetradeca-1,3,5,8-tetraenyloxiran-2-yl)butanoate

Standard CAS: 73466-12-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
73466-12-3
Multi CAS
Yes
Molecular Formula
C21H32O3
Molecular Weight
332.500000
Exact Mass
332.235145
InChI
InChI=1S/C21H32O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-16-19-20(24-19)17-15-18-21(22)23-2/h7-8,10-14,16,19-20H,3-6,9,15,17-18H2,1-2H3/b8-7-,11-10-,13-12+,16-14+/t19-,20-/m0/s1
InChIKey
WTKAVFHPLJFCMZ-NIBLXIPLSA-N

Computed Properties

Structural Parameters

Heavy atom count
24
Fraction Csp3
0.57
Rotatable bonds
13
H-bond acceptors
3
Molar refractivity
99.85
TPSA
38.83

LogP / Solubility

WLOGP
5.29
MLOGP
4.67
XLogP3
5.6
Consensus LogP
5.19
Log S (ESOL)
-4.38
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.11
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.77
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
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)
-0.99

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
No
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3.5

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