(Q105349889)

English

(E)-4-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-2-[(1S)-1,2-dihydroxyethyl]but-2-enal

chemical compound

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instance of

type of chemical entity

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subclass of

4-(5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-2-(1,2-dihydroxyethyl)but-2-enal

1 reference

based on heuristic

inferred from SMILES

mass

320.235144884 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₃₂O₃

0 references

canonical SMILES

O=CC(=CCC1C(=C)CCC2C(C)(C)CCCC12C)C(O)CO

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isomeric SMILES

C=C1CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1C/C=C(/C=O)[C@H](O)CO

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found in taxon

Alpinia chinensis

1 reference

stated in

Labdane Diterpenoids fromAlpinia chinensis

Identifiers

InChI

InChI=1S/C20H32O3/c1-14-6-9-18-19(2,3)10-5-11-20(18,4)16(14)8-7-15(12-21)17(23)13-22/h7,12,16-18,22-23H,1,5-6,8-11,13H2,2-4H3/b15-7-/t16-,17+,18-,20+/m0/s1

0 references

InChIKey

YKUBJKXDFHYMRG-SGCPRXINSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YKUBJKXDFHYMRG-SGCPRXINSA-N

(Q105349889)

(E)-4-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-2-[(1S)-1,2-dihydroxyethyl]but-2-enal

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Identifiers

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