CAS RN: 871540-97-5
C30 Ceramide (d18:1/30:0)
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.20250908 | 1mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS871540-97-5
- Purity/Analytical Methods: >99.0%
871540-97-5 / N-[(E,2S,3R)-1,3-dihydroxyoctadec-4-en-2-yl]triacontanamide
Basic Information
CAS
871540-97-5
Multi CAS
Yes
Molecular Formula
C48H95NO3
Molecular Weight
734.300000
Exact Mass
733.731196
InChI
InChI=1S/C48H95NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-48(52)49-46(45-50)47(51)43-41-39-37-35-33-31-16-14-12-10-8-6-4-2/h41,43,46-47,50-51H,3-40,42,44-45H2,1-2H3,(H,49,52)/b43-41+/t46-,47+/m0/s1
InChIKey
YTMSJWGKIOCDQT-NJLCVJHMSA-N
Computed Properties
Structural Parameters
Heavy atom count
52
Fraction Csp3
0.94
Rotatable bonds
44
H-bond acceptors
3
H-bond donors
3
Molar refractivity
230.19
TPSA
69.56
LogP / Solubility
WLOGP
15.02
MLOGP
13.29
XLogP3
20.4
Consensus LogP
16.24
Log S (ESOL)
-10.95
Class (ESOL)
Insoluble
Log S (Ali)
-16.43
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-22.18
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
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
3.47
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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