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Chemical structure of 8-Epidiosbulbin E acetate

GC35200

8-Epidiosbulbin E acetate

Also known as [(1R,2S,3S,5S,8S,10S,11R,13R)-8-(furan-3-yl)-10-methyl-6,15-dioxo-7,14-dioxatetracyclo[11.2.1.02,11.05,10]hexadecan-3-yl] acetate

8-Epidiosbulbin E acetate, a furanoid, is abundant in Dioscorea bulbifera L

ChemicalCAS91095-48-6MW388.41FormulaC21H24O7
CAS number
91095-48-6
Molecular weight
388.41
Formula
C21H24O7
Solubility
DMSO ： 100 mg/mL (257·46 mM; Need ultrasonic)
InChIKey
DYSOIAQEKRDXRB-GFTCARDDSA-N
Catalogue number
GC35200
Brand
GLPBIO
Computed properties PubChem CID 134715250 · XLogP 2.2 · TPSA 92 Ų · H-bond donors 0
XLogP
2.2
TPSA
92 Ų
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
3
Heavy atoms
28

SMILES CC(=O)O[C@H]1C[C@@H]2C(=O)O[C@@H](C[C@]2([C@H]3[C@H]1[C@H]4C[C@@H](C3)OC4=O)C)C5=COC=C5

Computed descriptors from PubChem (CID 134715250), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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