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CAS 38954-67-5 1-O-OCTYL-BETA-D-GLUCOPYRANOSIDE 2,3,4,6-TETRAACETATE molecular structure lightbox
CAS RN: 38954-67-5

1-O-OCTYL-BETA-D-GLUCOPYRANOSIDE 2,3,4,6-TETRAACETATE

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250531 1g / 5g Out of stock 8-10 business days Inquiry
  • Product code: SSC-146565
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 5g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 38954-67-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Shenzhen Inquiry

38954-67-5 / (3,4,5-triacetyloxy-6-octoxyoxan-2-yl)methyl acetate

Standard CAS: 38954-67-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
38954-67-5
Multi CAS
Yes
Molecular Formula
C22H36O10
Molecular Weight
460.500000
Exact Mass
460.230847
InChI
InChI=1S/C22H36O10/c1-6-7-8-9-10-11-12-27-22-21(31-17(5)26)20(30-16(4)25)19(29-15(3)24)18(32-22)13-28-14(2)23/h18-22H,6-13H2,1-5H3/t18-,19-,20+,21-,22-/m1/s1
InChIKey
RNGLREVZONTJLS-QMCAAQAGSA-N

Computed Properties

Structural Parameters

Heavy atom count
32
Fraction Csp3
0.82
Rotatable bonds
13
H-bond acceptors
10
Molar refractivity
111.28
TPSA
123.66

LogP / Solubility

WLOGP
2.45
MLOGP
2.18
XLogP3
4
Consensus LogP
2.88
Log S (ESOL)
-3.38
Class (ESOL)
Poorly soluble
Log S (Ali)
-5.1
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.24
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
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)
-3.79

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5

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