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CAS 34086-50-5 alpinumisoflavone molecular structure lightbox
CAS RN: 34086-50-5

alpinumisoflavone

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6 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250604 100mg In stock Shanghai Inquiry
Batchno.20250731 10mg In stock Shanghai Inquiry
Batchno.20250903 1mg In stock Shanghai Inquiry
Batchno.20260523 25mg In stock Shanghai Inquiry
Batchno.20260425 50mg In stock Shanghai Inquiry
Batchno.20250206 5mg Out of stock 30 business days Inquiry
  • Product code: starshine_CAS34086-50-5
  • Purity/Analytical Methods: >99.0%
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34086-50-5 / 5-hydroxy-7-(4-hydroxyphenyl)-2,2-dimethylpyrano[3,2-g]chromen-6-one

Standard CAS: 34086-50-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
34086-50-5
Multi CAS
Yes
Molecular Formula
C20H16O5
Molecular Weight
336.300000
Exact Mass
336.099774
InChI
InChI=1S/C20H16O5/c1-20(2)8-7-13-15(25-20)9-16-17(18(13)22)19(23)14(10-24-16)11-3-5-12(21)6-4-11/h3-10,21-22H,1-2H3
InChIKey
RQAMSFTXEFSBPK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
25
Aromatic heavy atom count
16
Fraction Csp3
0.15
Rotatable bonds
1
H-bond acceptors
5
H-bond donors
2
Molar refractivity
94.99
TPSA
79.9

LogP / Solubility

WLOGP
4.06
MLOGP
3.59
XLogP3
3.9
Consensus LogP
3.85
Log S (ESOL)
-4.89
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.25
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.33
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.89

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3

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