CAS RN: 57576-29-1

Cycloartane-3,24,25-triol

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250707 5mg Out of stock 30 business days Inquiry
  • Product code: starshine_CAS57576-29-1
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

57576-29-1 / 6-(6-hydroxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl)-2-methylheptane-2,3-diol

Standard CAS: 57576-29-1 Multi CAS: Yes

Basic Information

CAS
57576-29-1
Multi CAS
Yes
Molecular Formula
C30H52O3
Molecular Weight
460.700000
Exact Mass
460.391646
InChI
InChI=1S/C30H52O3/c1-19(8-11-24(32)26(4,5)33)20-12-14-28(7)22-10-9-21-25(2,3)23(31)13-15-29(21)18-30(22,29)17-16-27(20,28)6/h19-24,31-33H,8-18H2,1-7H3/t19-,20-,21+,22+,23+,24+,27-,28+,29-,30+/m1/s1
InChIKey
BKRIPHYESIGPJC-FACDIJBUSA-N

Physical Properties

Melting Point
154 - 156 °C
Physical Description
Solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
33
Fraction Csp3
1
Rotatable bonds
5
H-bond acceptors
3
H-bond donors
3
Molar refractivity
133.59
TPSA
60.69

LogP / Solubility

WLOGP
6.33
MLOGP
5.61
XLogP3
7.3
Consensus LogP
6.41
Log S (ESOL)
-6.36
Class (ESOL)
Insoluble
Log S (Ali)
-7.91
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.51
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.03

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
10

Get In Touch

Contact Us