CAS RN: 58551-69-2

Carboprost tromethamine

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8 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250415 100mg In stock Shanghai Inquiry
Batchno.20250516 10mg In stock Shanghai Inquiry
Batchno.20250602 1g Out of stock Inquiry
Batchno.20260131 250mg In stock Shanghai Inquiry
Batchno.20251209 25mg In stock Shanghai Inquiry
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Batchno.20260318 25mg / 100mg / 250mg Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS58551-69-2
  • Purity/Analytical Methods: >99.0%
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58551-69-2 / 2-amino-2-(hydroxymethyl)propane-1,3-diol;7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(3S)-3-hydroxy-3-methyloct-1-enyl]cyclopentyl]hept-5-enoic acid

Standard CAS: 58551-69-2 Multi CAS: Yes

Basic Information

CAS
58551-69-2
Multi CAS
Yes
Molecular Formula
C25H47NO8
Molecular Weight
489.600000
Exact Mass
489.330167
InChI
InChI=1S/C21H36O5.C4H11NO3/c1-3-4-9-13-21(2,26)14-12-17-16(18(22)15-19(17)23)10-7-5-6-8-11-20(24)25;5-4(1-6,2-7)3-8/h5,7,12,14,16-19,22-23,26H,3-4,6,8-11,13,15H2,1-2H3,(H,24,25);6-8H,1-3,5H2/b7-5-,14-12+;/t16-,17-,18+,19-,21+;/m1./s1
InChIKey
UMMADZJLZAPZAW-XOWPVRJPSA-N

Computed Properties

Structural Parameters

Heavy atom count
34
Fraction Csp3
0.8
Rotatable bonds
15
H-bond acceptors
8
H-bond donors
8
Molar refractivity
130.94
TPSA
184.7

LogP / Solubility

WLOGP
1.09
MLOGP
1
XLogP3
1.09
Consensus LogP
1.06
Log S (ESOL)
-2.57
Class (ESOL)
Moderately soluble
Log S (Ali)
-4.36
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.55
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.93

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5

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