CAS RN: 572-30-5
AVICULARIN
Product Availability
Choose a grade to view its available package options.
8 package records7 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250618 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20260328 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20251027 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20260503 | 250mg | Out of stock | Inquiry | |
| Batchno.20250620 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20251215 | 50mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS572-30-5
- Purity/Analytical Methods: >99.0%
572-30-5 / 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(3S,4R,5R)-3,4,5-trihydroxyoxan-2-yl]oxychromen-4-one
Basic Information
CAS
572-30-5
Multi CAS
Yes
Molecular Formula
C20H18O11
Molecular Weight
434.300000
Exact Mass
434.084911
InChI
InChI=1S/C20H18O11/c21-8-4-11(24)14-13(5-8)30-18(7-1-2-9(22)10(23)3-7)19(16(14)27)31-20-17(28)15(26)12(25)6-29-20/h1-5,12,15,17,20-26,28H,6H2/t12-,15-,17+,20?/m1/s1
InChIKey
PZZRDJXEMZMZFD-NNEMTEQFSA-N
Computed Properties
Structural Parameters
Heavy atom count
31
Aromatic heavy atom count
16
Fraction Csp3
0.25
Rotatable bonds
3
H-bond acceptors
11
H-bond donors
7
Molar refractivity
102.97
TPSA
190.28
LogP / Solubility
WLOGP
0.1
MLOGP
0.12
XLogP3
0.4
Consensus LogP
0.21
Log S (ESOL)
-2.78
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.19
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-2.93
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)
-5.3
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
Yes
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5
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