Linderane

C15H16O4CAS 13476-25-0260.29 g/mol

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AlkeneEpoxideEsterEtherLactone

Properties

Molecular formula
C15H16O4
Molar mass
260.29 g/mol
Exact mass
260.1049 Da
Melting point
190–191 °C (decomposes)
logP
2.61Crippen estimate
Polar surface area
52.0 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
0
Stereocentres
R, Sin SMILES atom order
Double bonds
ZE/Z, in SMILES order

Identifiers

CAS number
13476-25-0
SMILES
C/C1=C/CCC23O[C@@H]2[C@@H](OC3=O)c2c(C)coc2C1
InChIKey
KBMSVODXFLAQNJ-JELGAPFCSA-N
InChI
InChI=1S/C15H16O4/c1-8-4-3-5-15-13(19-15)12(18-14(15)16)11-9(2)7-17-10(11)6-8/h4,7,12-13H,3,5-6H2,1-2H3/b8-4-/t12-,13+,15?/m0/s1

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Type any one amount. The others follow from the molar mass.

Names and synonyms

4 names
  • 2H-10,1a-(Epoxymethano)oxireno[4,5]cyclodeca[1,2-b]furan-12-one, 3,6,10,10a-tetrahydro-5,9-dimethyl-, (1aS,4E,10S,10aS)-
  • 4βH-Germacra-1(10),7,11-trien-15-oic acid, 4,5β:8,12-diepoxy-6α-hydroxy-, γ-lactone, (E)-
  • 2H-10,1a-(Epoxymethano)oxireno[4,5]cyclodeca[1,2-b]furan-12-one, 3,6,10,10a-tetrahydro-5,9-dimethyl-, [1aS-(1aR*,4E,10R*,10aR*)]-
  • (1aS,4E,10S,10aS)-3,6,10,10a-Tetrahydro-5,9-dimethyl-2H-10,1a-(epoxymethano)oxireno[4,5]cyclodeca[1,2-b]furan-12-one

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Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

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