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CAS 126-17-0 SOLASODINE molecular structure lightbox
CAS RN: 126-17-0

SOLASODINE

Product Availability

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6 package records6 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260416 100mg In stock Shanghai Inquiry
Batchno.20250514 10mg In stock Shanghai Inquiry
Batchno.20251227 1mg In stock Shanghai, Wuhan Inquiry
Batchno.20250719 250mg In stock Shanghai Inquiry
Batchno.20260607 50mg In stock Shanghai Inquiry
Batchno.20260201 5mg In stock Shanghai Inquiry
  • Product code: SSC-031431
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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: 0.25g
  • Available purity: ≥95%
  • 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 126-17-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Shenzhen Inquiry

126-17-0 / (1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-piperidine]-16-ol

Standard CAS: 126-17-0 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
126-17-0
Multi CAS
No
Molecular Formula
C27H43NO2
Molecular Weight
413.600000
Exact Mass
413.329380
SMILES
C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC=C6[C@@]5(CC[C@@H](C6)O)C)C)C)NC1
InChI
InChI=1S/C27H43NO2/c1-16-7-12-27(28-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(29)8-10-25(18,3)21(20)9-11-26(22,24)4/h5,16-17,19-24,28-29H,6-15H2,1-4H3/t16-,17+,19+,20-,21+,22+,23+,24+,25+,26+,27-/m1/s1
InChIKey
KWVISVAMQJWJSZ-VKROHFNGSA-N

Physical Properties

Melting Point
200-202 °C
Physical Description
Solid; [Merck Index]
Appearance
HEXAGONAL PLATES FROM METHANOL OR BY SUBLIMATION IN HIGH VACUUM
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
30
Fraction Csp3
0.93
H-bond acceptors
3
H-bond donors
2
Molar refractivity
119.75
TPSA
41.49

LogP / Solubility

WLOGP
5.29
MLOGP
4.68
XLogP3
5.4
Consensus LogP
5.12
Log S (ESOL)
-5.74
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.77
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.74
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.49

Drug-likeness / Medicinal Chemistry

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

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