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CAS 84680-75-1 ASTRAGALOSIDE I molecular structure lightbox
CAS RN: 84680-75-1

ASTRAGALOSIDE I

Product Availability

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9 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260301 100mg In stock Shanghai Inquiry
Batchno.20260207 10mg In stock Shanghai Inquiry
Batchno.20260630 1g Out of stock Inquiry
Batchno.20250802 1mg In stock Shanghai Inquiry
Batchno.20260318 250mg Out of stock Inquiry
Batchno.20250406 25mg In stock Shanghai Inquiry
Batchno.20250825 50mg In stock Shanghai Inquiry
Batchno.20250527 5mg In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250629 20mg In stock Shanghai, Shandong Inquiry
  • Product code: SSC-192246
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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: 0.1g
  • Available purity: ≥95%
  • 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 84680-75-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 0 Out of Stock Shenzhen Inquiry

84680-75-1 / [3-acetyloxy-5-hydroxy-2-[[14-hydroxy-15-[5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethyl-9-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]oxan-4-yl] acetate

Standard CAS: 84680-75-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
84680-75-1
Multi CAS
Yes
Molecular Formula
C45H72O16
Molecular Weight
869.000000
Exact Mass
868.482036
InChI
InChI=1S/C45H72O16/c1-21(47)56-33-24(50)19-55-38(34(33)57-22(2)48)60-28-11-13-45-20-44(45)15-14-41(7)35(43(9)12-10-29(61-43)40(5,6)54)23(49)17-42(41,8)27(44)16-25(36(45)39(28,3)4)58-37-32(53)31(52)30(51)26(18-46)59-37/h23-38,46,49-54H,10-20H2,1-9H3/t23-,24+,25-,26+,27-,28-,29-,30+,31-,32+,33-,34+,35-,36-,37+,38-,41+,42-,43+,44-,45+/m0/s1
InChIKey
KXHCYYSIAXMSPA-OOCCOBHWSA-N

Computed Properties

Structural Parameters

Heavy atom count
61
Fraction Csp3
0.96
Rotatable bonds
9
H-bond acceptors
16
H-bond donors
7
Molar refractivity
212.83
TPSA
240.36

LogP / Solubility

WLOGP
1.87
MLOGP
1.72
XLogP3
2.4
Consensus LogP
2
Log S (ESOL)
-5.81
Class (ESOL)
Slightly soluble
Log S (Ali)
-8.03
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.94
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)
-6.7

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
10

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