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CAS 16837-52-8 Ammothamnine molecular structure lightbox
CAS RN: 16837-52-8

Ammothamnine

Product Availability

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11 package records10 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250724 100mg In stock Inquiry
Batchno.20250411 1g In stock Inquiry
Batchno.20251021 25g In stock Inquiry
Batchno.20250212 500mg In stock Inquiry
Batchno.20251021 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251102 100g In stock Shanghai Inquiry
Batchno.20260410 10g In stock Shanghai Inquiry
Batchno.20250806 1g In stock Shanghai Inquiry
Batchno.20251224 25g Out of stock Inquiry
Batchno.20260608 5g In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250909 20mg In stock Inquiry
  • Product code: SSC-073391
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 5g
  • Available purity: ≥98%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 16837-52-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥98% 0 Out of Stock Shenzhen Inquiry

16837-52-8 / (1R,2R,9S,13R,17S)-13-oxido-7-aza-13-azoniatetracyclo[7.7.1.02,7.013,17]heptadecan-6-one

Standard CAS: 16837-52-8 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
16837-52-8
Multi CAS
No
Molecular Formula
C15H24N2O2
Molecular Weight
264.360000
Exact Mass
264.183778
SMILES
C1C[C@@H]2[C@H]3CCC[N@+]4([C@H]3[C@@H](CCC4)CN2C(=O)C1)[O-]
InChI
InChI=1S/C15H24N2O2/c18-14-7-1-6-13-12-5-3-9-17(19)8-2-4-11(15(12)17)10-16(13)14/h11-13,15H,1-10H2/t11-,12+,13+,15-,17?/m0/s1
InChIKey
XVPBINOPNYFXID-LHDUFFHYSA-N

Physical Properties

Melting Point
208 °C
Appearance
White to off-white powder White dice from crystal
State
Solid
Storage Conditions
Store in original containers. Keep containers securely sealed. Store in a cool, dry, well-ventilated area. Store away from incompatible materials and foodstuff containers. Protect containers against physical damage and check regularly for leaks. Observe manufacturer's storing and handling recommendations. Recommended Storage Methods: Polyethylene or polypropylene container. Check all containers are clearly labelled and free from leaks.

Computed Properties

Structural Parameters

Heavy atom count
19
Fraction Csp3
0.93
H-bond acceptors
2
Molar refractivity
71.95
TPSA
43.37

LogP / Solubility

WLOGP
1.88
MLOGP
1.67
XLogP3
1
Consensus LogP
1.52
Log S (ESOL)
-2.67
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.09
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-2.94
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.99

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
4.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement Codes
P264, P270, P301+P317, P330, and P501

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