CAS RN: 1367351-41-4
Minimolide F
Product Availability
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6 package records0 with current stock2 grade groups
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250908 | 10mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS1367351-41-4
- Purity/Analytical Methods: >99.0%
1367351-41-4 / [(1S,3R,7R,9R,10R,11S,13R)-9,13-dimethyl-4-methylidene-5-oxo-6,14-dioxatetracyclo[8.4.0.01,13.03,7]tetradecan-11-yl] 2-methylpropanoate
Basic Information
CAS
1367351-41-4
Multi CAS
No
Molecular Formula
C19H26O5
Molecular Weight
334.400000
Exact Mass
334.178024
SMILES
C[C@@H]1C[C@@H]2[C@H](C[C@]34[C@H]1[C@H](C[C@]3(O4)C)OC(=O)C(C)C)C(=C)C(=O)O2
InChI
InChI=1S/C19H26O5/c1-9(2)16(20)23-14-8-18(5)19(24-18)7-12-11(4)17(21)22-13(12)6-10(3)15(14)19/h9-10,12-15H,4,6-8H2,1-3,5H3/t10-,12-,13-,14+,15-,18-,19+/m1/s1
InChIKey
PZGAEBIPXRQKFC-PZSYGAARSA-N
Computed Properties
Structural Parameters
Heavy atom count
24
Fraction Csp3
0.79
Rotatable bonds
2
H-bond acceptors
5
Molar refractivity
85.95
TPSA
65.13
LogP / Solubility
WLOGP
2.63
MLOGP
2.33
XLogP3
3
Consensus LogP
2.65
Log S (ESOL)
-3.44
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.2
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.26
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.89
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
7.5
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