Summary

Molecular formula: C17H26O5
SMILES: O=CC1=C2[C@@H]([C@H](C[C@H]1C)OC(=O)C)C([C@H]([C@]2(C)CO)O)(C)C
InChI: InChI=1S/C17H26O5/c1-9-6-12(22-10(2)20)14-13(11(9)7-18)17(5,8-19)15(21)16(14,3)4/h7,9,12,14-15,19,21H,6,8H2,1-5H3/t9-,12+,14-,15-,17-/m1/s1
InChIKey: LCAFIAWKWPMFHH-RTNSRKOKSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1=C2CCCC2CCC1

Scaffold Graph/Node level:
C1CCC2CCCC2C1

Scaffold Graph level:
C1CCC2CCCC2C1

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Chemical classification

Kingdom: Organic compounds
Super class: Organic oxygen compounds
Class: Organooxygen compounds
Sub class: Alcohols and polyols

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Synonymous chemical names:
7alpha-hydroxybotryenalol

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External chemical identifiers:
CID_102034773; NPATLAS_NPA009119; CHEMSPIDER_28285746

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Chemical structure download