CAS RN: 5155-43-1

METHYL-6-DEOXY-A-D-GLUCOPYRANOSIDE

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250701 1g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS5155-43-1
  • Purity/Analytical Methods: >99.0%
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5155-43-1 / 2-methoxy-6-methyloxane-3,4,5-triol

Standard CAS: 5155-43-1 Multi CAS: Yes

Basic Information

CAS
5155-43-1
Multi CAS
Yes
Molecular Formula
C7H14O5
Molecular Weight
178.180000
Exact Mass
178.084124
InChI
InChI=1S/C7H14O5/c1-3-4(8)5(9)6(10)7(11-2)12-3/h3-10H,1-2H3/t3-,4-,5+,6-,7+/m1/s1
InChIKey
OHWCAVRRXKJCRB-ZFYZTMLRSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
5
H-bond donors
3
Molar refractivity
39.36
TPSA
79.15

LogP / Solubility

WLOGP
-1.54
MLOGP
-1.36
XLogP3
-1.6
Consensus LogP
-1.5
Log S (ESOL)
0.09
Class (ESOL)
Highly soluble
Log S (Ali)
0.09
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.34
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
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)
-4.9

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4

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