CAS RN: 39524-08-8
Akebia saponin D
Product Availability
Choose a grade to view its available package options.
13 package records13 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250622 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20260304 | 100mg | In stock | Shanghai, Hebei | Inquiry |
| Batchno.20251110 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20250814 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20250830 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20251128 | 25mg | In stock | Shanghai, Shandong | Inquiry |
| Batchno.20250726 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20260628 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS39524-08-8
- Purity/Analytical Methods: >99.0%
39524-08-8 / [3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] 9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-(3,4,5-trihydroxyoxan-2-yl)oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
Basic Information
CAS
39524-08-8
Multi CAS
Yes
Molecular Formula
C47H76O18
Molecular Weight
929.100000
Exact Mass
928.503166
InChI
InChI=1S/C47H76O18/c1-42(2)13-15-47(41(59)65-40-37(58)34(55)32(53)26(63-40)20-61-38-36(57)33(54)31(52)25(18-48)62-38)16-14-45(5)22(23(47)17-42)7-8-28-43(3)11-10-29(64-39-35(56)30(51)24(50)19-60-39)44(4,21-49)27(43)9-12-46(28,45)6/h7,23-40,48-58H,8-21H2,1-6H3/t23-,24-,25+,26+,27+,28+,29-,30-,31+,32+,33-,34-,35+,36+,37+,38+,39-,40-,43-,44-,45+,46+,47-/m0/s1
InChIKey
CCRXMHCQWYVXTE-HMRSNRLKSA-N
Computed Properties
Structural Parameters
Heavy atom count
65
Fraction Csp3
0.94
Rotatable bonds
9
H-bond acceptors
18
H-bond donors
11
Molar refractivity
225.58
TPSA
294.98
LogP / Solubility
WLOGP
-0.25
MLOGP
-0.13
XLogP3
0.8
Consensus LogP
0.14
Log S (ESOL)
-4.85
Class (ESOL)
Slightly soluble
Log S (Ali)
-7
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.57
Class (SILICOS-IT)
Insoluble
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)
-8.56
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
10
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