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CAS 153355-70-5 Ginkgolide K molecular structure lightbox
CAS RN: 153355-70-5

Ginkgolide K

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5 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260328 100mg Out of stock Inquiry
Batchno.20250529 250mg Out of stock Inquiry
Batchno.20250224 25mg Out of stock Inquiry
Batchno.20251011 50mg Out of stock Inquiry
Batchno.20250819 5mg In stock Shanghai Inquiry
  • Product code: starshine_CAS153355-70-5
  • Purity/Analytical Methods: >99.0%
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153355-70-5 / (1S,3R,6R,7S,8S,10R,11S,12R,13R)-8-tert-butyl-6,12-dihydroxy-16-methyl-2,4,14,19-tetraoxahexacyclo[8.7.2.01,11.03,7.07,11.013,17]nonadec-16-ene-5,15,18-trione

Standard CAS: 153355-70-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
153355-70-5
Multi CAS
No
Molecular Formula
C20H22O9
Molecular Weight
406.400000
Exact Mass
406.126382
SMILES
CC1=C2[C@H]([C@@H]([C@]34[C@]25C(=O)O[C@@H]3C[C@H]([C@@]46[C@H](C(=O)O[C@H]6O5)O)C(C)(C)C)O)OC1=O
InChI
InChI=1S/C20H22O9/c1-6-9-10(27-13(6)23)11(21)19-8-5-7(17(2,3)4)18(19)12(22)14(24)28-16(18)29-20(9,19)15(25)26-8/h7-8,10-12,16,21-22H,5H2,1-4H3/t7-,8+,10+,11-,12-,16-,18-,19+,20+/m0/s1
InChIKey
MGXAKXRVQRODDX-LRSNRTHXSA-N

Computed Properties

Structural Parameters

Heavy atom count
29
Fraction Csp3
0.75
Rotatable bonds
1
H-bond acceptors
9
H-bond donors
2
Molar refractivity
90.6
TPSA
128.59

LogP / Solubility

WLOGP
-0.42
MLOGP
-0.35
XLogP3
0.1
Consensus LogP
-0.22
Log S (ESOL)
-2.09
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.59
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-1.95
Class (SILICOS-IT)
Soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.5

Drug-likeness / Medicinal Chemistry

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

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