Summary

Molecular formula: C16H18O7
SMILES: OC[C@@]12COC(=O)[C@]2(CC[C@H]1O)CC(=O)c1cc(O)ccc1O
InChI: InChI=1S/C16H18O7/c17-7-16-8-23-14(22)15(16,4-3-13(16)21)6-12(20)10-5-9(18)1-2-11(10)19/h1-2,5,13,17-19,21H,3-4,6-8H2/t13-,15+,16-/m1/s1
InChIKey: VPMBQAULVONHEM-VNQPRFMTSA-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 h

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External chemical identifiers:
CID_139587847; NPATLAS_NPA017071; CHEMSPIDER_78441429

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Chemical structure download