CAS RN: 6426-44-4
Glutinol acetate
Product Availability
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Inquiry |
|---|---|---|---|
| Batchno.20251108 | 5mg | Out of stock | Inquiry |
- Product code: starshine_CAS6426-44-4
- Purity/Analytical Methods: >99.0%
6426-44-4 / [(3S,6aS,6aS,6bR,8aR,12aR,14aR,14bS)-4,4,6a,6b,8a,11,11,14a-octamethyl-1,2,3,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydropicen-3-yl] acetate
Basic Information
CAS
6426-44-4
Multi CAS
Yes
Molecular Formula
C32H52O2
Molecular Weight
468.800000
Exact Mass
468.396731
InChI
InChI=1S/C32H52O2/c1-21(33)34-26-13-11-23-22(28(26,4)5)10-12-24-30(23,7)17-19-32(9)25-20-27(2,3)14-15-29(25,6)16-18-31(24,32)8/h10,23-26H,11-20H2,1-9H3/t23-,24+,25-,26+,29-,30+,31-,32+/m1/s1
InChIKey
CQQNBMVDVWGBMD-JZWVFCOJSA-N
Computed Properties
Structural Parameters
Heavy atom count
34
Fraction Csp3
0.91
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
140.27
TPSA
26.3
LogP / Solubility
WLOGP
8.74
MLOGP
7.72
XLogP3
9.7
Consensus LogP
8.72
Log S (ESOL)
-8.19
Class (ESOL)
Insoluble
Log S (Ali)
-9.71
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-10.08
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
Yes
Log Kp (skin permeation)
0.63
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
7.5
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