CAS RN: 148707-39-5
AcEGCG
Product Availability
Choose a grade to view its available package options.
10 package records10 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250521 | 10mg / 25mg / 100mg / 250mg | Confirm by inquiry | Shanghai, Shandong, Hebei | Inquiry |
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260211 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20250513 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20251028 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20260514 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20250518 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20250724 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS148707-39-5
- Purity/Analytical Methods: >99.0%
148707-39-5 / [(2R,3R)-5,7-diacetyloxy-2-(3,4,5-triacetyloxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 3,4,5-triacetyloxybenzoate
Basic Information
CAS
148707-39-5
Multi CAS
No
Molecular Formula
C38H34O19
Molecular Weight
794.700000
Exact Mass
794.169429
SMILES
CC(=O)OC1=CC2=C(C[C@H]([C@H](O2)C3=CC(=C(C(=C3)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C4=CC(=C(C(=C4)OC(=O)C)OC(=O)C)OC(=O)C)C(=C1)OC(=O)C
InChI
InChI=1S/C38H34O19/c1-16(39)48-26-13-28(49-17(2)40)27-15-34(57-38(47)25-11-32(52-20(5)43)37(55-23(8)46)33(12-25)53-21(6)44)35(56-29(27)14-26)24-9-30(50-18(3)41)36(54-22(7)45)31(10-24)51-19(4)42/h9-14,34-35H,15H2,1-8H3/t34-,35-/m1/s1
InChIKey
SVHJCTSSYQPWEV-VSJLXWSYSA-N
Computed Properties
Structural Parameters
Heavy atom count
57
Aromatic heavy atom count
18
Fraction Csp3
0.29
Rotatable bonds
11
H-bond acceptors
19
Molar refractivity
186.07
TPSA
245.93
LogP / Solubility
WLOGP
3.99
MLOGP
3.58
XLogP3
3.1
Consensus LogP
3.56
Log S (ESOL)
-6.79
Class (ESOL)
Insoluble
Log S (Ali)
-8.96
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.46
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-4.73
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
5.5
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