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CAS 643-13-0 D-fructose 6-(dihydrogen phosphate) molecular structure lightbox
CAS RN: 643-13-0

D-fructose 6-(dihydrogen phosphate)

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250211 100mg In stock Shanghai Inquiry
Batchno.20250903 1mg In stock Shanghai, Shandong, Guangdong, Hebei Inquiry
Batchno.20250211 25mg In stock Shanghai, Shandong, Guangdong Inquiry
Batchno.20251003 5mg In stock Shanghai, Chongqing Inquiry
  • Product code: starshine_CAS643-13-0
  • Purity/Analytical Methods: >99.0%
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643-13-0 / (2,3,4,6-tetrahydroxy-5-oxohexyl) dihydrogen phosphate

Standard CAS: 643-13-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
643-13-0
Multi CAS
Yes
Molecular Formula
C6H13O9P
Molecular Weight
260.140000
Exact Mass
260.029719
InChI
InChI=1S/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h4-7,9-11H,1-2H2,(H2,12,13,14)
InChIKey
GSXOAOHZAIYLCY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Fraction Csp3
0.83
Rotatable bonds
7
H-bond acceptors
7
H-bond donors
6
Molar refractivity
48.11
TPSA
164.75

LogP / Solubility

WLOGP
-3.26
MLOGP
-2.86
XLogP3
-4.3
Consensus LogP
-3.47
Log S (ESOL)
1.06
Class (ESOL)
Highly soluble
Log S (Ali)
0.66
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.52
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)
-6.62

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
3

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