Summary

Molecular formula: C21H32O3
SMILES: CO[C@@H]1C(=CC[C@H]2[C@@]([C@H]1O)(C)CC[C@@]1(C2=C(CC1)C(C)C)C)C=O
InChI: InChI=1S/C21H32O3/c1-13(2)15-8-9-20(3)10-11-21(4)16(17(15)20)7-6-14(12-22)18(24-5)19(21)23/h6,12-13,16,18-19,23H,7-11H2,1-5H3/t16-,18-,19+,20-,21-/m1/s1
InChIKey: CSMSQWRDDWOVOS-QNDFHXLGSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1=CCC2C3=CCCC3CCC2CC1

Scaffold Graph/Node level:
C1CCC2CCC3CCCC3C2CC1

Scaffold Graph level:
C1CCC2CCC3CCCC3C2CC1

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Chemical classification

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

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Synonymous chemical names:
cyathin q

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External chemical identifiers:
CID_127026239; NPATLAS_NPA016579; CHEMSPIDER_58909702; ZINC_ZINC000257399436

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Chemical structure download