Spiro(furan-3(2H),6'-(6H)naphtho(1,8-bc)furan)-2,8'-diol, 5-(3-furanyl)-3',4,4',5,5',5'a,7',8'-octahydro-7'-methyl-, (5'aS-(5'aalpha,6'beta(2S,5R),7'beta,8'beta))-

HCID 178295

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Basic information

CAS: 136176-59-5
Standard SMILES: CC1C(O)c2occ3c2C(CCC3)C12CC(c1ccoc1)OC2O
InChIKey: OHZUKELNHGLALS-UHFFFAOYSA-N
Molecular formula: C19H22O5
Average molar mass: 330.4 g/mol
Monoisotopic mass: 330.1467238

Names & identifiers

Preferred name: Spiro(furan-3(2H),6'-(6H)naphtho(1,8-bc)furan)-2,8'-diol, 5-(3-furanyl)-3',4,4',5,5',5'a,7',8'-octahydro-7'-methyl-, (5'aS-(5'aalpha,6'beta(2S*,5R*),7'beta,8'beta))-
IUPAC: 5'-(furan-3-yl)-10-methylspiro[2-oxatricyclo[6.3.1.04,12]dodeca-1(12),3-diene-9,3'-oxolane]-2',11-diol

Names & synonyms

136176-59-5Spiro(furan-3(2H),6'-(6H)naphtho(1,8-bc)furan)-2,8'-diol, 5-(3-furanyl)-3',4,4',5,5',5'a,7',8'-octahydro-7'-methyl-, (5'aS-(5'aalpha,6'beta(2S*,5R*),7'beta,8'beta))-DTXSID109292785'-(Furan-3-yl)-7-methyl-3,4,5,5a,7,8-hexahydrospiro[naphtho[1,8-bc]furan-6,3'-oxolane]-2',8-diol

Database identifiers

CAS: 136176-59-5
PubChem CID: 178295
DTXSID: DTXSID10929278

Properties

Computed structural properties

XLogP: 2.1
Topological polar surface area: 76 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 5
Rotatable bonds: 1
Heavy atoms: 24
Formal charge: 0
Complexity: 498

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