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CAS 24404-49-7 epipinoresinol-4′-O-β-D-glucoside molecular structure lightbox
CAS RN: 24404-49-7

epipinoresinol-4′-O-β-D-glucoside

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250726 5mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS24404-49-7
  • Purity/Analytical Methods: >99.0%
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24404-49-7 / 2-[4-[3-(4-hydroxy-3-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

Standard CAS: 24404-49-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
24404-49-7
Multi CAS
Yes
Molecular Formula
C26H32O11
Molecular Weight
520.500000
Exact Mass
520.194462
InChI
InChI=1S/C26H32O11/c1-32-18-7-12(3-5-16(18)28)24-14-10-35-25(15(14)11-34-24)13-4-6-17(19(8-13)33-2)36-26-23(31)22(30)21(29)20(9-27)37-26/h3-8,14-15,20-31H,9-11H2,1-2H3
InChIKey
QLJNETOQFQXTLI-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
37
Aromatic heavy atom count
12
Fraction Csp3
0.54
Rotatable bonds
7
H-bond acceptors
11
H-bond donors
5
Molar refractivity
126.41
TPSA
156.53

LogP / Solubility

WLOGP
0.66
MLOGP
0.62
XLogP3
0.5
Consensus LogP
0.59
Log S (ESOL)
-3.26
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.31
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.43
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.42

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
9.5

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