(Q105003613)

English

2-hydroxyethyl (1S,4S,5R,9S,10S,13R)-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

2-Hydroxyethyl 5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate

1 reference

based on heuristic

inferred from SMILES

mass

346.250794948 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₃₄O₃

0 references

canonical SMILES

O=C(OCCO)C1(C)CCCC2(C)C1CCC34CC(=C)C(CCC32)C4

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isomeric SMILES

C=C1C[C@@]23CC[C@H]4[C@@](C)(CCC[C@@]4(C)C(=O)OCCO)[C@H]2CC[C@@H]1C3

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found in taxon

Mikania sessilifolia

1 reference

stated in

Diterpenes from Mikania species

Identifiers

InChI

InChI=1S/C22H34O3/c1-15-13-22-10-7-17-20(2,18(22)6-5-16(15)14-22)8-4-9-21(17,3)19(24)25-12-11-23/h16-18,23H,1,4-14H2,2-3H3/t16-,17+,18-,20-,21-,22-/m1/s1

0 references

InChIKey

FWVLRVZJRVVTHX-RSBIIAMVSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FWVLRVZJRVVTHX-RSBIIAMVSA-N

(Q105003613)

2-hydroxyethyl (1S,4S,5R,9S,10S,13R)-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate

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Identifiers

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