CAS RN: 529-55-5
Prunin
Product Availability
Choose a grade to view its available package options.
9 package records9 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260316 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20250715 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20250603 | 1g | In stock | Shanghai | Inquiry |
| Batchno.20250312 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20250615 | 1mg / 5mg / 25mg / 100mg / 250mg | Confirm by inquiry | Shanghai, Shandong | Inquiry |
| Batchno.20250928 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20250905 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20250612 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20250211 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS529-55-5
- Purity/Analytical Methods: >99.0%
529-55-5 / (2S)-5-hydroxy-2-(4-hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one
Basic Information
CAS
529-55-5
Multi CAS
Yes
Molecular Formula
C21H22O10
Molecular Weight
434.400000
Exact Mass
434.121297
InChI
InChI=1S/C21H22O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-6,14,16,18-24,26-28H,7-8H2/t14-,16+,18+,19-,20+,21+/m0/s1
InChIKey
DLIKSSGEMUFQOK-SFTVRKLSSA-N
Computed Properties
Structural Parameters
Heavy atom count
31
Aromatic heavy atom count
12
Fraction Csp3
0.38
Rotatable bonds
4
H-bond acceptors
10
H-bond donors
6
Molar refractivity
102.93
TPSA
166.14
LogP / Solubility
WLOGP
-0.02
MLOGP
0.01
XLogP3
0.6
Consensus LogP
0.2
Log S (ESOL)
-2.55
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.11
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-2.95
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)
-5.38
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
6
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