(Q105330713)

English

(2S)-3-[2-[(4S,4aS,8aS)-4-hydroxy-2,5,5,8a-tetramethyl-3-oxo-4a,6,7,8-tetrahydro-4H-naphthalen-1-yl]ethyl]-2-hydroxy-2H-furan-5-one

chemical compound

In more languages

default values for all languages

No label defined

No description defined

Statements

type of chemical entity

0 references

1 reference

based on heuristic

inferred from SMILES

2-hydroxy-3-[2-(4-hydroxy-2,5,5,8a-tetramethyl-3-oxo-4a,6,7,8-tetrahydro-4H-naphthalen-1-yl)ethyl]-2H-furan-5-one

1 reference

based on heuristic

inferred from SMILES

348.193673996 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2S)-3-[2-[(4S,4aR,8aS)-4-hydroxy-2,5,5,8a-tetramethyl-3-oxo-4a,6,7,8-tetrahydro-4H-naphthalen-1-yl]ethyl]-2-hydroxy-2H-furan-5-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₈O₅

0 references

canonical SMILES

O=C1OC(O)C(=C1)CCC2=C(C(=O)C(O)C3C2(C)CCCC3(C)C)C

0 references

isomeric SMILES

CC1=C(CCC2=CC(=O)O[C@@H]2O)[C@@]2(C)CCCC(C)(C)[C@@H]2[C@H](O)C1=O

0 references

Leonurus sibiricus

1 reference

Labdane diterpenes of Leonurus sibiricus

Identifiers

InChI=1S/C20H28O5/c1-11-13(7-6-12-10-14(21)25-18(12)24)20(4)9-5-8-19(2,3)17(20)16(23)15(11)22/h10,16-18,23-24H,5-9H2,1-4H3/t16-,17+,18+,20-/m1/s1

0 references

XMFSQKSJFSGAHJ-DOADOZAASA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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