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Chemical structure of Arnicolide D

GC35395

Arnicolide D

Also known as [(1S,3aR,5R,5aR,8aR,9S,9aR)-1,5,8a-trimethyl-2,8-dioxo-3a,4,5,5a,9,9a-hexahydro-1H-azuleno[6,5-b]furan-9-yl] 2-methylprop-2-enoate

Arnicolide D is a sesquiterpene lactone isolated from Centipeda minima· Arnicolide D modulates the cell cycle, activates the caspase signaling pathway and inhibits the PI3K/AKT/mTOR and STAT3 signaling pathways· Arnicolide D inhibits Nasopharyngeal carcinoma (NPC) cell viability in a concentration- and time-dependent manner

ChemicalCAS34532-68-8MW332.39FormulaC19H24O5
CAS number
34532-68-8
Molecular weight
332.39
Formula
C19H24O5
Solubility
Soluble in DMSO
InChIKey
NZESEVTYUVXOTC-APDQSUQKSA-N
Catalogue number
GC35395
Brand
GLPBIO
Computed properties PubChem CID 182199 · XLogP 2.1 · TPSA 69.7 Ų · H-bond donors 0
XLogP
2.1
TPSA
69.7 Ų
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
24

SMILES C[C@@H]1C[C@@H]2[C@@H]([C@@H](C(=O)O2)C)[C@@H]([C@]3([C@H]1C=CC3=O)C)OC(=O)C(=C)C

Computed descriptors from PubChem (CID 182199), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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