(Q105194535)

English

(1S,4S,6S,9S,10R,13R,14S)-6-hydroxy-14-(hydroxymethyl)-5,5,9-trimethyltetracyclo[11.2.1.01,10.04,9]hexadecan-7-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

kaurane diterpenoid

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mass

320.235144884 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₃₂O₃

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canonical SMILES

O=C1CC2(C)C(CCC34CC(CO)C(CCC32)C4)C(C)(C)C1O

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isomeric SMILES

CC1(C)[C@H](O)C(=O)C[C@]2(C)[C@@H]1CC[C@]13C[C@H](CO)[C@H](CC[C@H]12)C3

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found in taxon

Stillingia sanguinolenta

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stated in

Tonantzitlolone and other Diterpenes fromStillingia sanguinolenta

Identifiers

InChI

InChI=1S/C20H32O3/c1-18(2)15-6-7-20-8-12(13(9-20)11-21)4-5-16(20)19(15,3)10-14(22)17(18)23/h12-13,15-17,21,23H,4-11H2,1-3H3/t12-,13-,15-,16+,17-,19-,20+/m1/s1

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InChIKey

OMWFJAIDJSZDFV-VTKGVCQTSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OMWFJAIDJSZDFV-VTKGVCQTSA-N

1 reference

(Q105194535)

(1S,4S,6S,9S,10R,13R,14S)-6-hydroxy-14-(hydroxymethyl)-5,5,9-trimethyltetracyclo[11.2.1.01,10.04,9]hexadecan-7-one

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Identifiers

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