[email protected]
CAS 507-89-1 PENNOGENIN molecular structure lightbox
CAS RN: 507-89-1

PENNOGENIN

Product Availability

Choose a grade to view its available package options.

4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250301 10mg In stock Shanghai Inquiry
Batchno.20260701 1mg In stock Shanghai Inquiry
Batchno.20251114 25mg In stock Shanghai Inquiry
Batchno.20250305 5mg In stock Shanghai Inquiry
  • Product code: starshine_CAS507-89-1
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

507-89-1 / 5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-8,16-diol

Standard CAS: 507-89-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
507-89-1
Multi CAS
Yes
Molecular Formula
C27H42O4
Molecular Weight
430.600000
Exact Mass
430.308310
InChI
InChI=1S/C27H42O4/c1-16-7-12-26(30-15-16)17(2)27(29)23(31-26)14-22-20-6-5-18-13-19(28)8-10-24(18,3)21(20)9-11-25(22,27)4/h5,16-17,19-23,28-29H,6-15H2,1-4H3/t16-,17-,19+,20-,21+,22+,23+,24+,25+,26-,27-/m1/s1
InChIKey
SYYHBUHOUUETMI-WJOMMTHPSA-N

Computed Properties

Structural Parameters

Heavy atom count
31
Fraction Csp3
0.93
H-bond acceptors
4
H-bond donors
2
Molar refractivity
119.16
TPSA
58.92

LogP / Solubility

WLOGP
4.83
MLOGP
4.28
XLogP3
4.4
Consensus LogP
4.5
Log S (ESOL)
-5.55
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.58
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.47
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)
-1.92

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
10

Customers Also Viewed

Get In Touch

Contact Us