Summary

Molecular formula: C16H16O8
SMILES: Oc1ccc(c(c1)C(=O)C[C@@]12CC[C@H]([C@]2(COC1=O)C(=O)O)O)O
InChI: InChI=1S/C16H16O8/c17-8-1-2-10(18)9(5-8)11(19)6-15-4-3-12(20)16(15,13(21)22)7-24-14(15)23/h1-2,5,12,17-18,20H,3-4,6-7H2,(H,21,22)/t12-,15+,16-/m1/s1
InChIKey: QNPQAWMNRANZDV-UHOFOFEASA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C(CC12CCCC1COC2=O)c1ccccc1

Scaffold Graph/Node level:
OC(CC12CCCC1COC2O)C1CCCCC1

Scaffold Graph level:
CC(CC12CCCC1CCC2C)C1CCCCC1

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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 i

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External chemical identifiers:
CID_139583735; NPATLAS_NPA002299; CHEMSPIDER_78440776

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Chemical structure download