![CAS 71386-38-4 (1aR)-1,1aβ,4,5,7,8,9,9aβ-Octahydro-3-hydroxy-1,1,2,5β-tetramethyl-7-methylene-6H-cyclopropa[3,4]cyclohept[1,2-e]inden-6-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/71386-38-4.gif)
CAS RN: 71386-38-4
(1aR)-1,1aβ,4,5,7,8,9,9aβ-Octahydro-3-hydroxy-1,1,2,5β-tetramethyl-7-methylene-6H-cyclopropa[3,4]cyclohept[1,2-e]inden-6-one
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.20251005 | 5mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS71386-38-4
- Purity/Analytical Methods: >99.0%
71386-38-4 / 7-hydroxy-4,8,11,11-tetramethyl-15-methylidenetetracyclo[7.6.0.02,6.010,12]pentadeca-1,6,8-trien-3-one
Basic Information
CAS
71386-38-4
Multi CAS
Yes
Molecular Formula
C20H24O2
Molecular Weight
296.400000
Exact Mass
296.177630
InChI
InChI=1S/C20H24O2/c1-9-6-7-13-17(20(13,4)5)15-11(3)19(22)12-8-10(2)18(21)16(12)14(9)15/h10,13,17,22H,1,6-8H2,2-5H3/t10-,13-,17-/m1/s1
InChIKey
BMHPRIPRPDSKRK-OMXAPOSASA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Aromatic heavy atom count
6
Fraction Csp3
0.55
H-bond acceptors
2
H-bond donors
1
Molar refractivity
88.32
TPSA
37.3
LogP / Solubility
WLOGP
4.62
MLOGP
4.08
XLogP3
4.5
Consensus LogP
4.4
Log S (ESOL)
-4.79
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.33
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.42
Class (SILICOS-IT)
Slightly 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)
-1.25
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4.5
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