CAS RN: 1867-91-0

rac 1-Oleoyl-2,3-dipalmitoyl Glycerol

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5 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260113 100mg In stock Shanghai Inquiry
Batchno.20260402 1g Out of stock Inquiry
Batchno.20250522 250mg In stock Shanghai Inquiry
Batchno.20260106 50mg In stock Shanghai, Wuhan Inquiry
Batchno.20250910 50mg / 100mg / 250mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS1867-91-0
  • Purity/Analytical Methods: >99.0%
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1867-91-0 / 2,3-di(hexadecanoyloxy)propyl (Z)-octadec-9-enoate

Standard CAS: 1867-91-0 Multi CAS: No

Basic Information

CAS
1867-91-0
Multi CAS
No
Molecular Formula
C53H100O6
Molecular Weight
833.400000
Exact Mass
832.751991
SMILES
CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCCCCCCCCCC
InChI
InChI=1S/C53H100O6/c1-4-7-10-13-16-19-22-25-26-29-31-34-37-40-43-46-52(55)58-49-50(59-53(56)47-44-41-38-35-32-28-24-21-18-15-12-9-6-3)48-57-51(54)45-42-39-36-33-30-27-23-20-17-14-11-8-5-2/h25-26,50H,4-24,27-49H2,1-3H3/b26-25-
InChIKey
YHMDGPZOSGBQRH-QPLCGJKRSA-N

Computed Properties

Structural Parameters

Heavy atom count
59
Fraction Csp3
0.91
Rotatable bonds
48
H-bond acceptors
6
Molar refractivity
251.87
TPSA
78.9

LogP / Solubility

WLOGP
16.98
MLOGP
15.02
XLogP3
22.1
Consensus LogP
18.03
Log S (ESOL)
-12.54
Class (ESOL)
Insoluble
Log S (Ali)
-18.66
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-24.93
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
4.26

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4.5

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