(Q105256904)

English

methyl 5-(4-acetyloxy-2,5,5,8a-tetramethyl-3-oxo-4a,6,7,8-tetrahydro-4H-naphthalen-1-yl)-3-methylpentanoate

group of stereoisomers with the chemical formula C₂₃H₃₆O₅

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Statements

instance of

group of stereoisomers

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1 reference

392.256274252 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₃H₃₆O₅

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canonical SMILES

O=C(OC1C(=O)C(=C(CCC(C)CC(=O)OC)C2(C)CCCC(C)(C)C12)C)C

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found in taxon

Cistus creticus

1 reference

stated in

Labdane diterpenoids from Cistus ladaniferus

Identifiers

InChI

InChI=1S/C23H36O5/c1-14(13-18(25)27-7)9-10-17-15(2)19(26)20(28-16(3)24)21-22(4,5)11-8-12-23(17,21)6/h14,20-21H,8-13H2,1-7H3

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InChIKey

SOEWGIQQJIQOBD-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

SOEWGIQQJIQOBD-UHFFFAOYSA-N

(Q105256904)

methyl 5-(4-acetyloxy-2,5,5,8a-tetramethyl-3-oxo-4a,6,7,8-tetrahydro-4H-naphthalen-1-yl)-3-methylpentanoate

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Identifiers

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