(Q105264841)

English

(1R,4aS,5S,6S,8aS)-6-hydroxy-1,4a,6-trimethyl-5-(3-methylidenepent-4-enyl)-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

labdanes

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mass

320.235144884 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₃₂O₃

0 references

canonical SMILES

O=C(O)C1(C)CCCC2(C)C(CCC(=C)C=C)C(O)(C)CCC12

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isomeric SMILES

C=CC(=C)CC[C@@H]1[C@@](C)(O)CC[C@H]2[C@]1(C)CCC[C@@]2(C)C(=O)O

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found in taxon

Sideritis varoi

1 reference

stated in

Diterpenoids from Sideritis arborescens subsp. Paulii

Identifiers

InChI

InChI=1S/C20H32O3/c1-6-14(2)8-9-16-18(3)11-7-12-19(4,17(21)22)15(18)10-13-20(16,5)23/h6,15-16,23H,1-2,7-13H2,3-5H3,(H,21,22)/t15-,16-,18-,19+,20-/m0/s1

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InChIKey

TULQSOIJEHVLNT-HNULKUCHSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

TULQSOIJEHVLNT-HNULKUCHSA-N

(Q105264841)

(1R,4aS,5S,6S,8aS)-6-hydroxy-1,4a,6-trimethyl-5-(3-methylidenepent-4-enyl)-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid

Statements

Identifiers

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