(Q105370909)

English

(4S,4aR)-4a-hydroxy-1,1,4,7-tetramethyl-1aH,2H,3H,4H,5H,7bH-cyclopropa[e]azulen-6-one

group of stereoisomers with the chemical formula C₁₅H₂₂O₂

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Statements

instance of

group of stereoisomers

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subclass of

aromadrendrane sesquiterpenoid

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inferred from

aromadrendrane sesquiterpenoid

mass

234.161979944 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

chemical formula

C₁₅H₂₂O₂

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canonical SMILES

O=C1C(=C2C3C(CCC(C)C2(O)C1)C3(C)C)C

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isomeric SMILES

CC1=C2C3C(CC[C@H](C)[C@]2(O)CC1=O)C3(C)C

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Identifiers

InChI

InChI=1S/C15H22O2/c1-8-5-6-10-13(14(10,3)4)12-9(2)11(16)7-15(8,12)17/h8,10,13,17H,5-7H2,1-4H3/t8-,10?,13?,15+/m0/s1

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InChIKey

ZBZKCPGSZOLGGP-QAJPGIAFSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

ZBZKCPGSZOLGGP-QAJPGIAFSA-N

1 reference

(Q105370909)

(4S,4aR)-4a-hydroxy-1,1,4,7-tetramethyl-1aH,2H,3H,4H,5H,7bH-cyclopropa[e]azulen-6-one

Statements

Identifiers

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