CAS RN: 66018-41-5
Zeaenol
Product Availability
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250708 | 5mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS66018-41-5
- Purity/Analytical Methods: >99.0%
66018-41-5 / (6E,12E)-8,9,10,18-tetrahydroxy-16-methoxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),6,12,15,17-pentaen-2-one
Basic Information
CAS
66018-41-5
Multi CAS
Yes
Molecular Formula
C19H24O7
Molecular Weight
364.400000
Exact Mass
364.152203
InChI
InChI=1S/C19H24O7/c1-11-5-3-7-14(20)18(23)15(21)8-4-6-12-9-13(25-2)10-16(22)17(12)19(24)26-11/h3-4,6-7,9-11,14-15,18,20-23H,5,8H2,1-2H3/b6-4+,7-3+
InChIKey
BPOLRDGTYHVUAY-DVFLZCIWSA-N
Computed Properties
Structural Parameters
Heavy atom count
26
Aromatic heavy atom count
6
Fraction Csp3
0.42
Rotatable bonds
1
H-bond acceptors
7
H-bond donors
4
Molar refractivity
94.96
TPSA
116.45
LogP / Solubility
WLOGP
1.39
MLOGP
1.24
XLogP3
2.2
Consensus LogP
1.61
Log S (ESOL)
-3.08
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.55
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.3
Class (SILICOS-IT)
Poorly 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
No
Log Kp (skin permeation)
-3.95
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
6
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- Product Code: starshine_CAS66022-17-1
- Purity/Analytical method: >99.0%
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