CAS RN: 39011-90-0
Albiflorin
Product Availability
Choose a grade to view its available package options.
8 package records8 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250223 | 1ml | In stock | Inquiry |
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251212 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20251105 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20250518 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20250607 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20260121 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20251106 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20250704 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS39011-90-0
- Purity/Analytical Methods: >99.0%
39011-90-0 / [4-hydroxy-6-methyl-8-oxo-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7-oxatricyclo[4.3.0.03,9]nonan-9-yl]methyl benzoate
Basic Information
CAS
39011-90-0
Multi CAS
Yes
Molecular Formula
C23H28O11
Molecular Weight
480.500000
Exact Mass
480.163162
InChI
InChI=1S/C23H28O11/c1-21-8-13(25)12-7-23(21,33-19-17(28)16(27)15(26)14(9-24)32-19)22(12,20(30)34-21)10-31-18(29)11-5-3-2-4-6-11/h2-6,12-17,19,24-28H,7-10H2,1H3/t12-,13+,14+,15+,16-,17+,19-,21-,22-,23-/m0/s1
InChIKey
QQUHMASGPODSIW-ICECTASOSA-N
Computed Properties
Structural Parameters
Heavy atom count
34
Aromatic heavy atom count
6
Fraction Csp3
0.65
Rotatable bonds
6
H-bond acceptors
11
H-bond donors
5
Molar refractivity
109.97
TPSA
172.21
LogP / Solubility
WLOGP
-1.51
MLOGP
-1.3
XLogP3
-1
Consensus LogP
-1.27
Log S (ESOL)
-1.6
Class (ESOL)
Soluble
Log S (Ali)
-2.41
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.25
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-6.73
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
10
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