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CAS 24512-62-7 Gardenoside molecular structure lightbox
CAS RN: 24512-62-7

Gardenoside

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6 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250821 10mg In stock Shanghai Inquiry
Batchno.20251118 50mg Out of stock 8-10 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250501 10mg In stock Shanghai Inquiry
Batchno.20250701 25mg In stock Shanghai Inquiry
Batchno.20251104 50mg In stock Shanghai Inquiry
Batchno.20251231 5mg In stock Shanghai Inquiry
  • Product code: starshine_CAS24512-62-7
  • Purity/Analytical Methods: >99.0%
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24512-62-7 / methyl 7-hydroxy-7-(hydroxymethyl)-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,7a-dihydro-1H-cyclopenta[c]pyran-4-carboxylate

Standard CAS: 24512-62-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
24512-62-7
Multi CAS
No
Molecular Formula
C17H24O11
Molecular Weight
404.400000
Exact Mass
404.131862
SMILES
COC(=O)C1=COC(C2C1C=CC2(CO)O)OC3C(C(C(C(O3)CO)O)O)O
InChI
InChI=1S/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7-,9-,10-,11-,12+,13-,15+,16+,17-/m1/s1
InChIKey
XJMPAUZQVRGFRE-AYDWLWLASA-N

Computed Properties

Structural Parameters

Heavy atom count
28
Fraction Csp3
0.71
Rotatable bonds
5
H-bond acceptors
11
H-bond donors
6
Molar refractivity
87.98
TPSA
175.37

LogP / Solubility

WLOGP
-3.26
MLOGP
-2.84
XLogP3
-2.8
Consensus LogP
-2.97
Log S (ESOL)
0.04
Class (ESOL)
Highly soluble
Log S (Ali)
-0.52
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.18
Class (SILICOS-IT)
Very soluble

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
No
Log Kp (skin permeation)
-7.5

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
7

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