[email protected]
CAS 110241-19-5 Ganoderic acid N molecular structure lightbox
CAS RN: 110241-19-5

Ganoderic acid N

Product Availability

Choose a grade to view its available package options.

1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250424 5mg In stock Shanghai Inquiry
  • Product code: starshine_CAS110241-19-5
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

110241-19-5 / 6-hydroxy-6-(7-hydroxy-4,4,10,13,14-pentamethyl-3,11,15-trioxo-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl)-2-methyl-4-oxoheptanoic acid

Ganoderic acid N

Standard CAS: 110241-19-5 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
110241-19-5
Multi CAS
Yes
Molecular Formula
C30H42O8
Molecular Weight
530.600000
Exact Mass
530.287968
SMILES
CC(CC(=O)CC(C)(C1CC(=O)C2(C1(CC(=O)C3=C2C(CC4C3(CCC(=O)C4(C)C)C)O)C)C)O)C(=O)O
InChI
InChI=1S/C30H42O8/c1-15(25(36)37)10-16(31)13-29(6,38)20-12-22(35)30(7)24-17(32)11-19-26(2,3)21(34)8-9-27(19,4)23(24)18(33)14-28(20,30)5/h15,17,19-20,32,38H,8-14H2,1-7H3,(H,36,37)
InChIKey
XXHBQOHASACCAP-UHFFFAOYSA-N
Synonyms
Ganoderic acid N

Physical Properties

Melting Point
164 - 167 °C
Physical Description
Solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
38
Fraction Csp3
0.77
Rotatable bonds
6
H-bond acceptors
7
H-bond donors
3
Molar refractivity
137.89
TPSA
146.04

LogP / Solubility

WLOGP
3.45
MLOGP
3.08
XLogP3
0.7
Consensus LogP
2.41
Log S (ESOL)
-4.91
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.41
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.7
Class (SILICOS-IT)
Insoluble

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
Yes
Log Kp (skin permeation)
-3.5

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
8.5

Customers Also Viewed

Get In Touch

Contact Us