Summary

Molecular formula: C15H22O4
SMILES: OC[C@@]1(C)[C@H]2[C@@H]1[C@@]1(C)[C@H](C)CC(=O)C=C1[C@H]([C@H]2O)O
InChI: InChI=1S/C15H22O4/c1-7-4-8(17)5-9-11(18)12(19)10-13(15(7,9)3)14(10,2)6-16/h5,7,10-13,16,18-19H,4,6H2,1-3H3/t7-,10-,11-,12+,13+,14+,15+/m1/s1
InChIKey: DNDJVLRCUVQAAL-RFKXLPOUSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1C=C2CCC3CC3C2CC1

Scaffold Graph/Node level:
OC1CCC2C(CCC3CC32)C1

Scaffold Graph level:
CC1CCC2C(CCC3CC32)C1

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Chemical classification

Kingdom: Organic compounds
Super class: Lipids and lipid-like molecules
Class: Prenol lipids
Sub class: Sesquiterpenoids

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Synonymous chemical names:
rulepidatriol

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External chemical identifiers:
CID_15479509; NPATLAS_NPA017069; CHEMSPIDER_78441939; ZINC_ZINC000014775407

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Chemical structure download