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Chemical structure of Salvinorin A-d3

GC52309

Salvinorin A-d3

Also known as methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(furan-3-yl)-6a,10b-dimethyl-4,10-dioxo-9-(2,2,2-trideuterioacetyl)oxy-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate

An Analytical Reference Standard

ChemicalCAS791114-98-2MW435.5FormulaC23H25D3O8
CAS number
791114-98-2
Molecular weight
435.5
Formula
C23H25D3O8
Solubility
DMF： 1 mg/ml,DMSO： 2 mg/ml,Ethanol： insol,PBS (pH 7·2)： insol
InChIKey
OBSYBRPAKCASQB-YJADOILASA-N
Catalogue number
GC52309
Brand
GLPBIO
Computed properties PubChem CID 168323136 · XLogP 2.5 · TPSA 109 Ų · H-bond donors 0
XLogP
2.5
TPSA
109 Ų
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
5
Heavy atoms
31

SMILES [2H]C([2H])([2H])C(=O)O[C@H]1C[C@H]([C@@]2(CC[C@H]3C(=O)O[C@@H](C[C@@]3([C@H]2C1=O)C)C4=COC=C4)C)C(=O)OC

Computed descriptors from PubChem (CID 168323136), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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