CAS RN: 153409-16-6
Capsaicin β-D-Glucopyranoside
Product Availability
Choose a grade to view its available package options.
7 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251026 | 100mg | Out of stock | Inquiry | |
| Batchno.20260407 | 10mg | Out of stock | Inquiry | |
| Batchno.20250402 | 1mg | Out of stock | Inquiry | |
| Batchno.20260524 | 25mg | Out of stock | Inquiry | |
| Batchno.20250416 | 50mg | Out of stock | Inquiry | |
| Batchno.20260120 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20260318 | 5mg | Out of stock | Inquiry |
- Product code: ICTC2548
- Purity/Analytical Methods: >90.0%(HPLC)
153409-16-6 / (E)-N-[[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]-8-methylnon-6-enamide
Basic Information
CAS
153409-16-6
Multi CAS
No
Molecular Formula
C24H37NO8
Molecular Weight
467.600000
Exact Mass
467.251917
SMILES
CC(C)/C=C/CCCCC(=O)NCC1=CC(=C(C=C1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)OC
InChI
InChI=1S/C24H37NO8/c1-15(2)8-6-4-5-7-9-20(27)25-13-16-10-11-17(18(12-16)31-3)32-24-23(30)22(29)21(28)19(14-26)33-24/h6,8,10-12,15,19,21-24,26,28-30H,4-5,7,9,13-14H2,1-3H3,(H,25,27)/b8-6+/t19-,21-,22+,23-,24-/m1/s1
InChIKey
HEYWYCJIIXVRPS-FDOPSVQKSA-N
Computed Properties
Structural Parameters
Heavy atom count
33
Aromatic heavy atom count
6
Fraction Csp3
0.62
Rotatable bonds
12
H-bond acceptors
8
H-bond donors
5
Molar refractivity
121.68
TPSA
137.71
LogP / Solubility
WLOGP
1.26
MLOGP
1.14
XLogP3
1
Consensus LogP
1.13
Log S (ESOL)
-2.88
Class (ESOL)
Moderately soluble
Log S (Ali)
-4.31
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.19
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.68
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
No
Egan
No
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5
