(Q104967480)

English

(1R,4aR,5S,7S)-3,8-dimethyl-5-propan-2-yl-1,2,4a,5,6,7-hexahydronaphthalene-1,7-diol

chemical compound

In more languages

Statements

type of chemical entity

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cadinane sesquiterpenoid

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236.177630008 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₅H₂₄O₂

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canonical SMILES

OC1C(=C2C(O)CC(=CC2C(C1)C(C)C)C)C

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isomeric SMILES

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

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1 reference

Two new sesquiterpenes from Acorus calamus

Identifiers

InChI=1S/C15H24O2/c1-8(2)11-7-13(16)10(4)15-12(11)5-9(3)6-14(15)17/h5,8,11-14,16-17H,6-7H2,1-4H3/t11-,12-,13-,14+/m0/s1

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CPFGTXNXFPHSEY-XDQVBPFNSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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