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CAS 22467-07-8 Gymnemagenin molecular structure lightbox
CAS RN: 22467-07-8

Gymnemagenin

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4 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260626 10mg In stock Shanghai Inquiry
Batchno.20260226 1mg / 5mg Confirm by inquiry Shanghai Inquiry
Batchno.20251214 25mg Out of stock Inquiry
Batchno.20250430 5mg Out of stock Inquiry
  • Product code: starshine_CAS22467-07-8
  • Purity/Analytical Methods: >99.0%
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22467-07-8 / 4a,9-bis(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-3,4,5,10-tetrol

Standard CAS: 22467-07-8 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
22467-07-8
Multi CAS
No
Molecular Formula
C30H50O6
Molecular Weight
506.700000
Exact Mass
506.360739
SMILES
CC1(CC2C3=CCC4C5(CCC(C(C5CCC4(C3(CC(C2(C(C1O)O)CO)O)C)C)(C)CO)O)C)C
InChI
InChI=1S/C30H50O6/c1-25(2)13-18-17-7-8-20-26(3)11-10-21(33)27(4,15-31)19(26)9-12-28(20,5)29(17,6)14-22(34)30(18,16-32)24(36)23(25)35/h7,18-24,31-36H,8-16H2,1-6H3/t18-,19+,20+,21-,22-,23-,24-,26-,27-,28+,29+,30-/m0/s1
InChIKey
VKJLHZZPVLQJKG-ABHKXHSUSA-N

Physical Properties

Melting Point
301 - 303 °C
Physical Description
Solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
36
Fraction Csp3
0.93
Rotatable bonds
2
H-bond acceptors
6
H-bond donors
6
Molar refractivity
137.71
TPSA
121.38

LogP / Solubility

WLOGP
3.03
MLOGP
2.7
XLogP3
4
Consensus LogP
3.24
Log S (ESOL)
-4.76
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.9
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.71
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
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)
-3.66

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.56
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
10

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