CAS RN: 472-26-4
3β,5,14-Trihydroxy-5β-bufa-20,22-dienolide
Product Availability
Choose a grade to view its available package options.
9 package records9 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260515 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20260410 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20250521 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20250831 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20260112 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20250306 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS472-26-4
- Purity/Analytical Methods: >99.0%
472-26-4 / 5-[(3S,5S,10R,13R,14S,17R)-3,5,14-trihydroxy-10,13-dimethyl-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pyran-2-one
Basic Information
CAS
472-26-4
Multi CAS
Yes
Molecular Formula
C24H34O5
Molecular Weight
402.500000
Exact Mass
402.240624
InChI
InChI=1S/C24H34O5/c1-21-9-5-16(25)13-23(21,27)11-7-19-18(21)6-10-22(2)17(8-12-24(19,22)28)15-3-4-20(26)29-14-15/h3-4,14,16-19,25,27-28H,5-13H2,1-2H3/t16-,17+,18?,19?,21+,22+,23-,24-/m0/s1
InChIKey
PBSOJKPTQWWJJD-KCDWZGJBSA-N
Computed Properties
Structural Parameters
Heavy atom count
29
Aromatic heavy atom count
6
Fraction Csp3
0.79
Rotatable bonds
1
H-bond acceptors
5
H-bond donors
3
Molar refractivity
108.37
TPSA
90.9
LogP / Solubility
WLOGP
3.36
MLOGP
2.98
XLogP3
2.5
Consensus LogP
2.95
Log S (ESOL)
-4.54
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.28
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.18
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.79
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
7.5
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