CAS RN: 863780-90-9
Methyl diacetoxy-6-gingerdiol
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.20250405 | 5mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS863780-90-9
- Purity/Analytical Methods: >99.0%
863780-90-9 / [3-acetyloxy-1-(3,4-dimethoxyphenyl)decan-5-yl] acetate
Basic Information
CAS
863780-90-9
Multi CAS
Yes
Molecular Formula
C22H34O6
Molecular Weight
394.500000
Exact Mass
394.235539
InChI
InChI=1S/C22H34O6/c1-6-7-8-9-19(27-16(2)23)15-20(28-17(3)24)12-10-18-11-13-21(25-4)22(14-18)26-5/h11,13-14,19-20H,6-10,12,15H2,1-5H3
InChIKey
QCJKXQWAFFZFLJ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
28
Aromatic heavy atom count
6
Fraction Csp3
0.64
Rotatable bonds
13
H-bond acceptors
6
Molar refractivity
107.73
TPSA
71.06
LogP / Solubility
WLOGP
4.47
MLOGP
3.96
XLogP3
5.1
Consensus LogP
4.51
Log S (ESOL)
-4.4
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.02
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.49
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.95
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3.5
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