CAS RN: 30964-13-7
Cynarin
Product Availability
Choose a grade to view its available package options.
12 package records10 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251105 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20251004 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20250928 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20250531 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20260205 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20250501 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20260224 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS30964-13-7
- Purity/Analytical Methods: >99.0%
30964-13-7 / (1R,3R,4S,5R)-1,3-bis[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-4,5-dihydroxycyclohexane-1-carboxylic acid
Basic Information
CAS
30964-13-7
Multi CAS
Yes
Molecular Formula
C25H24O12
Molecular Weight
516.400000
Exact Mass
516.126776
InChI
InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(24(34)35,11-19(30)23(20)33)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,33H,11-12H2,(H,34,35)/b7-3+,8-4+/t19-,20-,23+,25-/m1/s1
InChIKey
YDDUMTOHNYZQPO-RVXRWRFUSA-N
Computed Properties
Structural Parameters
Heavy atom count
37
Aromatic heavy atom count
12
Fraction Csp3
0.24
Rotatable bonds
7
H-bond acceptors
11
H-bond donors
7
Molar refractivity
125.2
TPSA
211.28
LogP / Solubility
WLOGP
1.03
MLOGP
0.94
XLogP3
1.5
Consensus LogP
1.16
Log S (ESOL)
-3.47
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.54
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.71
Class (SILICOS-IT)
Slightly soluble
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)
-5.14
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
6
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