CAS RN: 631-01-6
Quillaic acid
Product Availability
Choose a grade to view its available package options.
8 package records7 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260331 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20260616 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20251211 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20260112 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20250503 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20260308 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS631-01-6
- Purity/Analytical Methods: >99.0%
631-01-6 / (4aR,5R,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-9-formyl-5,10-dihydroxy-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
Basic Information
CAS
631-01-6
Multi CAS
Yes
Molecular Formula
C30H46O5
Molecular Weight
486.700000
Exact Mass
486.334525
InChI
InChI=1S/C30H46O5/c1-25(2)13-14-30(24(34)35)19(15-25)18-7-8-21-26(3)11-10-22(32)27(4,17-31)20(26)9-12-28(21,5)29(18,6)16-23(30)33/h7,17,19-23,32-33H,8-16H2,1-6H3,(H,34,35)/t19-,20+,21+,22-,23+,26-,27-,28+,29+,30+/m0/s1
InChIKey
MQUFAARYGOUYEV-UAWZMHPWSA-N
Computed Properties
Structural Parameters
Heavy atom count
35
Fraction Csp3
0.87
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
3
Molar refractivity
134.46
TPSA
94.83
LogP / Solubility
WLOGP
5.38
MLOGP
4.77
XLogP3
6.1
Consensus LogP
5.42
Log S (ESOL)
-6.12
Class (ESOL)
Insoluble
Log S (Ali)
-7.44
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.53
Class (SILICOS-IT)
Insoluble
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)
-1.87
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
8.5
Customers Also Viewed
-
-
-
1-ETHYL-1-METHYLSUCCINIC ACID
- CAS RN: 631-31-2
- Product Code: starshine_CAS631-31-2
- Purity/Analytical method: >99.0%
-
-
-
