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CAS 15291-77-7 Ginkgolide B molecular structure lightbox
CAS RN: 15291-77-7

Ginkgolide B

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10 package records8 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251001 100mg In stock Shanghai, Tianjin Inquiry
Batchno.20260411 10mg In stock Shanghai Inquiry
Batchno.20260609 1g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250826 1mg In stock Shanghai Inquiry
Batchno.20250608 250mg In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250330 5g Out of stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251127 10mg In stock Inquiry
Batchno.20250419 20mg In stock Inquiry
Batchno.20260505 250mg Out of stock Inquiry
Batchno.20260515 50mg In stock Inquiry
  • Product code: ICTG0553
  • Purity/Analytical Methods: >93.0%(HPLC)
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15291-77-7 / (1R,3R,6R,7S,8S,10R,11R,12S,13S,16S,17R)-8-tert-butyl-6,12,17-trihydroxy-16-methyl-2,4,14,19-tetraoxahexacyclo[8.7.2.01,11.03,7.07,11.013,17]nonadecane-5,15,18-trione

Standard CAS: 15291-77-7 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
15291-77-7
Multi CAS
No
Molecular Formula
C20H24O10
Molecular Weight
424.400000
Exact Mass
424.136947
SMILES
C[C@@H]1C(=O)O[C@@H]2[C@]1([C@@]34C(=O)O[C@H]5[C@]3([C@@H]2O)[C@@]6([C@@H](C5)C(C)(C)C)[C@H](C(=O)O[C@H]6O4)O)O
InChI
InChI=1S/C20H24O10/c1-6-12(23)28-11-9(21)18-8-5-7(16(2,3)4)17(18)10(22)13(24)29-15(17)30-20(18,14(25)27-8)19(6,11)26/h6-11,15,21-22,26H,5H2,1-4H3/t6-,7+,8-,9-,10+,11+,15+,17+,18+,19-,20-/m1/s1
InChIKey
SQOJOAFXDQDRGF-ZMVGXLHTSA-N

Computed Properties

Structural Parameters

Heavy atom count
30
Fraction Csp3
0.85
Rotatable bonds
1
H-bond acceptors
10
H-bond donors
3
Molar refractivity
92.01
TPSA
148.82

LogP / Solubility

WLOGP
-1.37
MLOGP
-1.18
XLogP3
-0.4
Consensus LogP
-0.98
Log S (ESOL)
-1.61
Class (ESOL)
Soluble
Log S (Ali)
-2.05
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-1.28
Class (SILICOS-IT)
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)
-6.28

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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