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Chemical structure of RapaBlock

GC73491

RapaBlock

Also known as (1R,9S,12S,13R,14S,17R,18Z,21S,23S,24R,25S,27R)-1,14-dihydroxy-12-[(E)-1-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]prop-1-en-2-yl]-23,25-dimethoxy-13,19,21,27-tetramethyl-17-[3-(1-oxidopyridin-1-ium-2-yl)propyl]-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone

RapaBlock is a potent, non-immunosuppressive and brain-impermeable FKBP12 ligand

ChemicalCAS2474076-02-1MW899.12FormulaC49H74N2O13
CAS number
2474076-02-1
Molecular weight
899.12
Formula
C49H74N2O13
Solubility
DMSO ： 100 mg/mL (111·22 mM; Need ultrasonic)
InChIKey
IYSZVJNYZFPLJF-SMZOFQQGSA-N
Catalogue number
GC73491
Brand
GLPBIO
Computed properties PubChem CID 171713748 · XLogP 2.3 · TPSA 204 Ų · H-bond donors 3
XLogP
2.3
TPSA
204 Ų
H-bond donors
3
H-bond acceptors
13
Rotatable bonds
9
Heavy atoms
64

SMILES C[C@@H]1C[C@@H]([C@@H]2[C@H](C[C@H]([C@@](O2)(C(=O)C(=O)N3CCCC[C@H]3C(=O)O[C@@H]([C@@H]([C@H](CC(=O)[C@@H](/C=C(\C1)/C)CCCC4=CC=CC=[N+]4[O-])O)C)/C(=C/[C@@H]5CC[C@H]([C@@H](C5)OC)O)/C)O)C)OC)OC

Computed descriptors from PubChem (CID 171713748), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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