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Chemical structure of HMG499

GC70390

HMG499

Also known as (3S,7R,8S,9S,10R,13R,14S,17R)-17-[(2R)-6-hydroxy-6-prop-2-enylnon-8-en-2-yl]-4,4,10,13-tetramethyl-1,2,3,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,7-diol

HMG499 is a potent and selective HMG-CoA reductase inhibitor with an IC50 of 0·41 μM

ChemicalCAS2416941-68-7MW498.78FormulaC33H54O3
CAS number
2416941-68-7
Molecular weight
498.78
Formula
C33H54O3
InChIKey
LPLLZSOEZAVGBO-XHBYIXHHSA-N
Catalogue number
GC70390
Brand
GLPBIO
Computed properties PubChem CID 162640582 · XLogP 8 · TPSA 60.7 Ų · H-bond donors 3
XLogP
8
TPSA
60.7 Ų
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
9
Heavy atoms
36

SMILES C[C@H](CCCC(CC=C)(CC=C)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@H](C=C4[C@@]3(CC[C@@H](C4(C)C)O)C)O)C

Computed descriptors from PubChem (CID 162640582), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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