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CAS 56144-12-8 6-SIALYL-D-LACTOSE* molecular structure lightbox
CAS RN: 56144-12-8

6-SIALYL-D-LACTOSE*

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250916 1mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS56144-12-8
  • Purity/Analytical Methods: >99.0%
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56144-12-8 / 5-acetamido-4-hydroxy-6-(1,2,3-trihydroxypropyl)-2-[[3,4,5-trihydroxy-6-[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-2-yl]methoxy]oxane-2-carboxylic acid

Standard CAS: 56144-12-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
56144-12-8
Multi CAS
Yes
Molecular Formula
C23H39NO19
Molecular Weight
633.600000
Exact Mass
633.211628
InChI
InChI=1S/C23H39NO19/c1-6(27)24-11-7(28)2-23(22(37)38,43-19(11)12(30)8(29)3-25)39-5-10-13(31)14(32)17(35)21(41-10)42-18-9(4-26)40-20(36)16(34)15(18)33/h7-21,25-26,28-36H,2-5H2,1H3,(H,24,27)(H,37,38)/t7-,8+,9+,10+,11+,12+,13-,14-,15+,16+,17+,18+,19+,20?,21-,23-/m0/s1
InChIKey
TYALNJQZQRNQNQ-UVBUFIKTSA-N

Computed Properties

Structural Parameters

Heavy atom count
43
Fraction Csp3
0.91
Rotatable bonds
11
H-bond acceptors
18
H-bond donors
13
Molar refractivity
130.05
TPSA
335.08

LogP / Solubility

WLOGP
-8.22
MLOGP
-7.18
XLogP3
-7.8
Consensus LogP
-7.73
Log S (ESOL)
2.14
Class (ESOL)
Highly soluble
Log S (Ali)
1.18
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
1.73
Class (SILICOS-IT)
Highly 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)
-12.42

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
10

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