Summary

Molecular formula: C7H12O5
SMILES: OC[C@@H]1[C@@H](O)[C@H](O)[C@H]([C@H]2[C@@H]1O2)O
InChI: InChI=1S/C7H12O5/c8-1-2-3(9)4(10)5(11)7-6(2)12-7/h2-11H,1H2/t2-,3-,4+,5-,6-,7+/m1/s1
InChIKey: YQLWKYQDOQEWRD-GEGSFZHJSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1CCC2OC2C1

Scaffold Graph/Node level:
C1CCC2OC2C1

Scaffold Graph level:
C1CCC2CC2C1

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Chemical classification

Kingdom: Organic compounds
Super class: Organoheterocyclic compounds
Class: Oxepanes

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Synonymous chemical names:
cyclophellitol

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External chemical identifiers:
CID_164227; CAS_126661-83-4; NPATLAS_NPA011341; CHEMSPIDER_144010

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Chemical structure download