CAS RN: 623927-14-0
“Kaempferol 3-O-(4”-O-trans-p-coumaroyl)rhamnopyranoside”
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20251124 | 5mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS623927-14-0
- Purity/Analytical Methods: >99.0%
623927-14-0 / [(2S,3R,4S,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-4,5-dihydroxy-2-methyloxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
Basic Information
CAS
623927-14-0
Multi CAS
No
Molecular Formula
C30H26O12
Molecular Weight
578.500000
Exact Mass
578.142426
InChI
InChI=1S/C30H26O12/c1-14-27(41-22(35)11-4-15-2-7-17(31)8-3-15)25(37)26(38)30(39-14)42-29-24(36)23-20(34)12-19(33)13-21(23)40-28(29)16-5-9-18(32)10-6-16/h2-14,25-27,30-34,37-38H,1H3/b11-4+/t14-,25-,26+,27-,30-/m0/s1
InChIKey
RFTKNPGPPJOOBI-NTWDEFLTSA-N
Computed Properties
Structural Parameters
Heavy atom count
42
Aromatic heavy atom count
22
Fraction Csp3
0.2
Rotatable bonds
6
H-bond acceptors
12
H-bond donors
6
Molar refractivity
146.91
TPSA
196.35
LogP / Solubility
WLOGP
2.75
MLOGP
2.47
XLogP3
3.5
Consensus LogP
2.91
Log S (ESOL)
-5.15
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.29
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.43
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)
-4.29
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
7.5
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