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Chemical structure of Rupestonic acid

GC37572

Rupestonic acid

Also known as 2-[(5R,8S,8aS)-3,8-dimethyl-2-oxo-4,5,6,7,8,8a-hexahydro-1H-azulen-5-yl]prop-2-enoic acid

Rupestonic acid, a sesquiterpene, can inhibit influenza virus

ChemicalCAS83161-56-2MW248.32FormulaC15H20O3
CAS number
83161-56-2
Molecular weight
248.32
Formula
C15H20O3
Solubility
DMSO ： 100 mg/mL (402·71 mM; Need ultrasonic)
InChIKey
ZFHSKBJBODQVBX-AXTRIDKLSA-N
Catalogue number
GC37572
Brand
GLPBIO
Computed properties PubChem CID 24094149 · XLogP 2.4 · TPSA 54.4 Ų · H-bond donors 1
XLogP
2.4
TPSA
54.4 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
18

SMILES C[C@H]1CC[C@H](CC2=C(C(=O)C[C@@H]12)C)C(=C)C(=O)O

Computed descriptors from PubChem (CID 24094149), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Pricing
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Documents
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