[email protected]
CAS 467-55-0 Hecogenin molecular structure lightbox
CAS RN: 467-55-0

Hecogenin

Product Availability

Choose a grade to view its available package options.

9 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityInquiry
Batchno.20260427 100mg In stock Inquiry
Batchno.20260318 1g In stock Inquiry
Batchno.20250822 25g In stock Inquiry
Batchno.20250305 500mg In stock Inquiry
Batchno.20250228 5g In stock Inquiry
Batch No.PackageAvailabilityInquiry
Batchno.20251004 100mg Out of stock Inquiry
Batchno.20250828 1g Out of stock Inquiry
Batchno.20250611 250mg Out of stock Inquiry
Batchno.20260219 5g Out of stock Inquiry
  • Product code: ICTH0003
  • Purity/Analytical Methods: >80.0%(GC)
GET A QUOTE

467-55-0 / 16-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-10-one

Standard CAS: 467-55-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
467-55-0
Multi CAS
Yes
Molecular Formula
C27H42O4
Molecular Weight
430.600000
Exact Mass
430.308310
InChI
InChI=1S/C27H42O4/c1-15-7-10-27(30-14-15)16(2)24-22(31-27)12-21-19-6-5-17-11-18(28)8-9-25(17,3)20(19)13-23(29)26(21,24)4/h15-22,24,28H,5-14H2,1-4H3
InChIKey
QOLRLLFJMZLYQJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
31
Fraction Csp3
0.96
H-bond acceptors
4
H-bond donors
1
Molar refractivity
118.11
TPSA
55.76

LogP / Solubility

WLOGP
4.97
MLOGP
4.4
XLogP3
4.8
Consensus LogP
4.72
Log S (ESOL)
-5.64
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.68
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.59
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
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)
-1.82

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us