CAS RN: 40289-37-0
4-hydroxysphinganine (C17 base)
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250331 | 5mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS40289-37-0
- Purity/Analytical Methods: >99.0%
40289-37-0 / (2S,3S,4R)-2-aminoheptadecane-1,3,4-triol
Basic Information
CAS
40289-37-0
Multi CAS
No
Molecular Formula
C17H37NO3
Molecular Weight
303.500000
Exact Mass
303.277344
InChI
InChI=1S/C17H37NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-16(20)17(21)15(18)14-19/h15-17,19-21H,2-14,18H2,1H3/t15-,16+,17-/m0/s1
InChIKey
NKOLYWXODIHTSI-BBWFWOEESA-N
Computed Properties
Structural Parameters
Heavy atom count
21
Fraction Csp3
1
Rotatable bonds
15
H-bond acceptors
4
H-bond donors
4
Molar refractivity
88.15
TPSA
86.71
LogP / Solubility
WLOGP
2.73
MLOGP
2.41
XLogP3
4.1
Consensus LogP
3.08
Log S (ESOL)
-2.45
Class (ESOL)
Moderately soluble
Log S (Ali)
-4.02
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.7
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.63
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4
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