Summary

Molecular formula: C14H16O6
SMILES: COC(=O)[C@@H]1CC[C@H]([C@@H]1C(=O)c1cc(O)ccc1O)O
InChI: InChI=1S/C14H16O6/c1-20-14(19)8-3-5-11(17)12(8)13(18)9-6-7(15)2-4-10(9)16/h2,4,6,8,11-12,15-17H,3,5H2,1H3/t8-,11-,12-/m1/s1
InChIKey: SXPHWVWHKNUWLH-GGZOMVNGSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C(c1ccccc1)C1CCCC1

Scaffold Graph/Node level:
OC(C1CCCCC1)C1CCCC1

Scaffold Graph level:
CC(C1CCCCC1)C1CCCC1

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Chemical classification

Kingdom: Organic compounds
Super class: Organic oxygen compounds
Class: Organooxygen compounds
Sub class: Carbonyl compounds

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Synonymous chemical names:
(+)-applanatumol z

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External chemical identifiers:
CID_139584171; NPATLAS_NPA003880; CHEMSPIDER_78440839

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Chemical structure download