CAS RN: 125263-65-2
Rubiprasin A
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250315 | 5mg | Out of stock | 30 business days | Inquiry |
- Product code: starshine_CAS125263-65-2
- Purity/Analytical Methods: >99.0%
125263-65-2 / [(3S,4aR,6aR,6aS,6bR,7S,8aR,12aR,14aR,14bR)-6a,7-dihydroxy-4,4,6a,6b,8a,11,11,14b-octamethyl-13-oxo-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl] acetate
Basic Information
CAS
125263-65-2
Multi CAS
No
Molecular Formula
C32H52O5
Molecular Weight
516.800000
Exact Mass
516.381475
SMILES
CC(=O)O[C@H]1CC[C@]2([C@H](C1(C)C)CC[C@@]3([C@@H]2CC(=O)[C@]4([C@]3([C@H](C[C@@]5([C@H]4CC(CC5)(C)C)C)O)C)O)C)C
InChI
InChI=1S/C32H52O5/c1-19(33)37-25-11-12-29(7)20(27(25,4)5)10-13-30(8)21(29)16-23(34)32(36)22-17-26(2,3)14-15-28(22,6)18-24(35)31(30,32)9/h20-22,24-25,35-36H,10-18H2,1-9H3/t20-,21+,22+,24-,25-,28+,29-,30+,31-,32+/m0/s1
InChIKey
KHSRLAHIQUDPFJ-VWPWYMCRSA-N
Computed Properties
Structural Parameters
Heavy atom count
37
Fraction Csp3
0.94
Rotatable bonds
1
H-bond acceptors
5
H-bond donors
2
Molar refractivity
143.53
TPSA
83.83
LogP / Solubility
WLOGP
6.08
MLOGP
5.39
XLogP3
6.7
Consensus LogP
6.06
Log S (ESOL)
-6.81
Class (ESOL)
Insoluble
Log S (Ali)
-8.19
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.19
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
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)
-1.55
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
10
Customers Also Viewed
-
Asiaticoside B
- CAS RN: 125265-68-1
- Product Code: starshine_CAS125265-68-1
- Purity/Analytical method: >99.0%
-
2-(cyclohexylcarbonyl)-2,3,6,7-tetrahydro-4H-pyrazino [2,1-alpha]isoquinolin-4-one
- CAS RN: 125273-86-1
- Product Code: starshine_CAS125273-86-1
- Purity/Analytical method: >99.0%
-
2-(N-FORMYLHEXAHYDROHIPPUROYL)-1,2,3,4-TETRAHYDROISOQUINOLIN-1-ONE
- CAS RN: 125273-88-3
- Product Code: starshine_CAS125273-88-3
- Purity/Analytical method: >99.0%
-
2,5,8,11-Tetraoxatridecan-13-ol, 1,1,1-triphenyl-
- CAS RN: 125274-16-0
- Product Code: SSC-029999
-
2-(AMINOSULFONYL)-N,N-DIMETHYL-3-PYRIDINECARBOXAMIDE
- CAS RN: 125274-65-9
- Product Code: starshine_CAS125274-65-9
- Purity/Analytical method: >99.0%
-
Kihadanin A
- CAS RN: 125276-62-2
- Product Code: starshine_CAS125276-62-2
- Purity/Analytical method: >99.0%
![CAS 125273-86-1 2-(cyclohexylcarbonyl)-2,3,6,7-tetrahydro-4H-pyrazino [2,1-alpha]isoquinolin-4-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/125273-86-1.gif)
