[email protected]
CAS 50468-56-9 4-O-BETA-GALACTOPYRANOSYL-D-MANNOPYRANOSE molecular structure lightbox
CAS RN: 50468-56-9

4-O-BETA-GALACTOPYRANOSYL-D-MANNOPYRANOSE

Product Availability

Choose a grade to view its available package options.

5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260117 100mg In stock Shanghai Inquiry
Batchno.20251023 10mg In stock Shanghai Inquiry
Batchno.20260503 250mg In stock Shanghai Inquiry
Batchno.20250402 25mg In stock Shanghai Inquiry
Batchno.20251005 50mg In stock Shanghai Inquiry
  • Product code: starshine_CAS50468-56-9
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

50468-56-9 / (2S,3R,4R,5R)-2,3,5,6-tetrahydroxy-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanal

Standard CAS: 50468-56-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
50468-56-9
Multi CAS
Yes
Molecular Formula
C12H22O11
Molecular Weight
342.300000
Exact Mass
342.116212
InChI
InChI=1S/C12H22O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h1,4-12,14-21H,2-3H2/t4-,5-,6-,7-,8+,9+,10-,11-,12+/m1/s1
InChIKey
DKXNBNKWCZZMJT-QMRWEYQWSA-N

Computed Properties

Structural Parameters

Heavy atom count
23
Fraction Csp3
0.92
Rotatable bonds
8
H-bond acceptors
11
H-bond donors
8
Molar refractivity
69.81
TPSA
197.37

LogP / Solubility

WLOGP
-5.55
MLOGP
-4.87
XLogP3
-5
Consensus LogP
-5.14
Log S (ESOL)
2.07
Class (ESOL)
Highly soluble
Log S (Ali)
1.64
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
1.77
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)
-8.75

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
7

Customers Also Viewed

Get In Touch

Contact Us