(Q105167970)

English

[(1S,2S,4S,5S,9R,10S,13R,15R)-15-hydroxy-5-(hydroxymethyl)-5,9-dimethyl-14-methylidene-2-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

[15-Hydroxy-5-(hydroxymethyl)-5,9-dimethyl-14-methylidene-2-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate

1 reference

based on heuristic

inferred from SMILES

mass

362.245709568 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(1R,2R,4R,5R,9S,10R,13S,15R)-15-hydroxy-5-(hydroxymethyl)-5,9-dimethyl-14-methylidene-2-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate

2 references

based on heuristic

inferred from InChIKey

1 reference

C₂₂H₃₄O₄

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canonical SMILES

O=C(OC1CC2C(C)(CO)CCCC2(C)C3CCC4C(=C)C(O)C13C4)C

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isomeric SMILES

C=C1[C@@H]2CC[C@@H]3[C@](C2)([C@@H](OC(C)=O)C[C@@H]2[C@@](C)(CO)CCC[C@]23C)[C@@H]1O

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found in taxon

Sideritis arguta

2 references

stated in

Antioxidant and anticholinesterase activity evaluation of ent-kaurane diterpenoids from Sideritis arguta.

stated in

Antioxidant and anticholinesterase activity evaluation of ent-kaurane diterpenoids from Sideritis arguta.

Identifiers

InChI

InChI=1S/C22H34O4/c1-13-15-6-7-16-21(4)9-5-8-20(3,12-23)17(21)10-18(26-14(2)24)22(16,11-15)19(13)25/h15-19,23,25H,1,5-12H2,2-4H3/t15-,16+,17-,18+,19-,20-,21+,22-/m1/s1

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InChIKey

MMPSMJLFQSNILL-PHGHRUFFSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MMPSMJLFQSNILL-PHGHRUFFSA-N

(Q105167970)

[(1S,2S,4S,5S,9R,10S,13R,15R)-15-hydroxy-5-(hydroxymethyl)-5,9-dimethyl-14-methylidene-2-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate

Statements

Identifiers

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