[email protected]
CAS 15404-76-9 Fuscaxanthone C molecular structure lightbox
CAS RN: 15404-76-9

Fuscaxanthone C

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250923 5mg Out of stock Inquiry
  • Product code: starshine_CAS15404-76-9
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

15404-76-9 / 1-hydroxy-3,6,7-trimethoxy-2,8-bis(3-methylbut-2-enyl)xanthen-9-one

Standard CAS: 15404-76-9 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
15404-76-9
Multi CAS
No
Molecular Formula
C26H30O6
Molecular Weight
438.500000
Exact Mass
438.204239
SMILES
CC(=CCC1=C(C=C2C(=C1O)C(=O)C3=C(C(=C(C=C3O2)OC)OC)CC=C(C)C)OC)C
InChI
InChI=1S/C26H30O6/c1-14(2)8-10-16-18(29-5)12-20-23(24(16)27)25(28)22-17(11-9-15(3)4)26(31-7)21(30-6)13-19(22)32-20/h8-9,12-13,27H,10-11H2,1-7H3
InChIKey
FCIKYGUVHWZSJV-UHFFFAOYSA-N

Physical Properties

Melting Point
120 - 121 °C
Physical Description
Solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
32
Aromatic heavy atom count
14
Fraction Csp3
0.35
Rotatable bonds
7
H-bond acceptors
6
H-bond donors
1
Molar refractivity
127.58
TPSA
78.13

LogP / Solubility

WLOGP
5.7
MLOGP
5.04
XLogP3
6.9
Consensus LogP
5.88
Log S (ESOL)
-6.01
Class (ESOL)
Insoluble
Log S (Ali)
-7.27
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.08
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.35

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

Customers Also Viewed

Get In Touch

Contact Us