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CAS 98064-96-1 HEXADECYL–D-MALTOSIDE 0.1 MM SOLU molecular structure lightbox
CAS RN: 98064-96-1

HEXADECYL–D-MALTOSIDE 0.1 MM SOLU

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3 package records3 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250301 100mg In stock Inquiry
Batchno.20260507 500mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250830 100mg / 250mg Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS98064-96-1
  • Purity/Analytical Methods: >99.0%
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98064-96-1 / 2-[6-hexadecoxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

Standard CAS: 98064-96-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
98064-96-1
Multi CAS
Yes
Molecular Formula
C28H54O11
Molecular Weight
566.700000
Exact Mass
566.366613
InChI
InChI=1S/C28H54O11/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-36-27-25(35)23(33)26(20(18-30)38-27)39-28-24(34)22(32)21(31)19(17-29)37-28/h19-35H,2-18H2,1H3/t19-,20-,21-,22+,23-,24-,25-,26-,27-,28-/m1/s1
InChIKey
GTQCHJYVKDXMRU-YMEALESQSA-N

Computed Properties

Structural Parameters

Heavy atom count
39
Fraction Csp3
1
Rotatable bonds
20
H-bond acceptors
11
H-bond donors
7
Molar refractivity
142.66
TPSA
178.53

LogP / Solubility

WLOGP
1.11
MLOGP
1.02
XLogP3
3.6
Consensus LogP
1.91
Log S (ESOL)
-2.73
Class (ESOL)
Moderately soluble
Log S (Ali)
-5.01
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.66
Class (SILICOS-IT)
Insoluble

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)
-5.39

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
9

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