CAS RN: 548-04-9
Hypericin
Product Availability
Choose a grade to view its available package options.
14 package records11 with current stock4 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251022 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20260623 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20250627 | 1g | In stock | Shanghai | Inquiry |
| Batchno.20250702 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20250510 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20251021 | 50mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS548-04-9
- Purity/Analytical Methods: >99.0%
548-04-9 / 9,11,13,16,18,20-hexahydroxy-5,24-dimethyloctacyclo[13.11.1.12,10.03,8.04,25.019,27.021,26.014,28]octacosa-1(26),2,4(25),5,8,10,12,14(28),15(27),16,18,20,23-tridecaene-7,22-dione
Basic Information
CAS
548-04-9
Multi CAS
Yes
Molecular Formula
C30H16O8
Molecular Weight
504.400000
Exact Mass
504.084517
InChI
InChI=1S/C30H16O8/c1-7-3-9(31)19-23-15(7)16-8(2)4-10(32)20-24(16)28-26-18(12(34)6-14(36)22(26)30(20)38)17-11(33)5-13(35)21(29(19)37)25(17)27(23)28/h3-6,33-38H,1-2H3
InChIKey
YDOIFHVUBCIUHF-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
38
Aromatic heavy atom count
28
Fraction Csp3
0.07
H-bond acceptors
8
H-bond donors
6
Molar refractivity
145.73
TPSA
155.52
LogP / Solubility
WLOGP
5.08
MLOGP
4.51
XLogP3
5.7
Consensus LogP
5.1
Log S (ESOL)
-6.71
Class (ESOL)
Insoluble
Log S (Ali)
-7.37
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.16
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.19
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
6.5
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