(Q105346737)

English

16,17-Epoxykauran-18-oic acid

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

5',9'-dimethylspiro[oxirane-2,14'-tetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane]-5'-carboxylic acid

1 reference

based on heuristic

inferred from SMILES

mass

318.21949482 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1'S,2S,4'S,5'R,9'S,10'R,13'R)-5',9'-dimethylspiro[oxirane-2,14'-tetracyclo[11.2.1.01,10.04,9]hexadecane]-5'-carboxylic acid

1 reference

based on heuristic

inferred from InChI

(1'S,2S,4'S,5'S,9'S,10'R,13'R)-5',9'-dimethylspiro[oxirane-2,14'-tetracyclo[11.2.1.01,10.04,9]hexadecane]-5'-carboxylic acid

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₀O₃

0 references

canonical SMILES

O=C(O)C1(C)CCCC2(C)C1CCC34CC(CCC32)C5(OC5)C4

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isomeric SMILES

C[C@@]12CCC[C@@](C)(C(=O)O)[C@H]1CC[C@@]13C[C@@H](CC[C@H]12)[C@@]1(CO1)C3

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found in taxon

Baccharis minutiflora

1 reference

stated in

Diterpenes from Baccharis species

Mikania arrojadoi

1 reference

stated in

An epoxygermacranolide and further constituents from Mikania species

Identifiers

InChI

InChI=1S/C20H30O3/c1-17-7-3-8-18(2,16(21)22)14(17)6-9-19-10-13(4-5-15(17)19)20(11-19)12-23-20/h13-15H,3-12H2,1-2H3,(H,21,22)/t13-,14+,15+,17-,18-,19+,20+/m1/s1

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InChIKey

YDGXRSPFVBSYLM-INIPNLRTSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YDGXRSPFVBSYLM-INIPNLRTSA-N

1 reference

(Q105346737)

16,17-Epoxykauran-18-oic acid

Statements

Identifiers

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