(Q105237450)

English

(1R,4R,4aS,6R,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,5,7,8-hexahydro-2H-naphthalene-1,6,8a-triol

chemical compound

In more languages

Statements

type of chemical entity

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cadinane sesquiterpenoid

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256.203844756 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₅H₂₈O₃

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canonical SMILES

OC1(C)CCC2(O)C(C1)C(CCC2(O)C)C(C)C

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isomeric SMILES

CC(C)[C@H]1CC[C@@](C)(O)[C@]2(O)CC[C@@](C)(O)C[C@@H]12

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1 reference

Two new sesquiterpenes from Acorus calamus

Identifiers

InChI=1S/C15H28O3/c1-10(2)11-5-6-14(4,17)15(18)8-7-13(3,16)9-12(11)15/h10-12,16-18H,5-9H2,1-4H3/t11-,12+,13-,14-,15+/m1/s1

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RJFZKASCQJPZRY-KHMAMNHCSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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