Summary

Molecular formula: C18H22O8
SMILES: COC([C@@]12COC(=O)[C@]2(CC[C@@H]1O)CC(=O)c1cc(O)ccc1O)OC
InChI: InChI=1S/C18H22O8/c1-24-16(25-2)18-9-26-15(23)17(18,6-5-14(18)22)8-13(21)11-7-10(19)3-4-12(11)20/h3-4,7,14,16,19-20,22H,5-6,8-9H2,1-2H3/t14-,17-,18+/m0/s1
InChIKey: VCCZNZDGMFCWPD-JCGIZDLHSA-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 f

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External chemical identifiers:
CID_139584676; NPATLAS_NPA005687; CHEMSPIDER_78440914

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Chemical structure download