CAS RN: 73213-63-5
hainanolidol
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.20251022 | 5mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS73213-63-5
- Purity/Analytical Methods: >99.0%
73213-63-5 / (11S,12S,13S,16S,17R)-17-hydroxy-8,16-dimethyl-14-oxapentacyclo[11.2.2.19,12.01,11.04,10]octadeca-4,7,9-triene-6,15-dione
Basic Information
CAS
73213-63-5
Multi CAS
Yes
Molecular Formula
C19H20O4
Molecular Weight
312.400000
Exact Mass
312.136159
InChI
InChI=1S/C19H20O4/c1-8-5-11(20)6-10-3-4-19-9(2)16(21)17(23-18(19)22)13-7-12(8)14(10)15(13)19/h5-6,9,13,15-17,21H,3-4,7H2,1-2H3/t9-,13+,15+,16-,17+,19?/m1/s1
InChIKey
XGXBIRLBBHSIBS-CJRRSTQMSA-N
Computed Properties
Structural Parameters
Heavy atom count
23
Aromatic heavy atom count
7
Fraction Csp3
0.58
H-bond acceptors
4
H-bond donors
1
Molar refractivity
83.19
TPSA
63.6
LogP / Solubility
WLOGP
1.48
MLOGP
1.32
XLogP3
0.4
Consensus LogP
1.07
Log S (ESOL)
-2.93
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.19
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-2.92
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.57
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
10
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