(Q105215344)

English

(3S)-5-[(1S,2R,4aR,7S,8aR)-7-hydroperoxy-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-1-en-3-ol

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

5-(7-Hydroperoxy-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl)-3-methylpent-1-en-3-ol

1 reference

based on heuristic

inferred from SMILES

mass

322.250794948 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(5alpha,8alpha,9S,10beta,13R)-2beta-Hydroperoxycleroda-3,14-diene-13-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₄O₃

0 references

canonical SMILES

OOC1C=C(C)C2(C)CCC(C)C(C)(CCC(O)(C=C)C)C2C1

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isomeric SMILES

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

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found in taxon

Aristolochia chamissonis

1 reference

stated in

Rearranged (4→2)-abeo-clerodane and clerodane diterpenes from Aristolochia chamissonis

Identifiers

InChI

InChI=1S/C20H34O3/c1-7-18(4,21)10-11-20(6)14(2)8-9-19(5)15(3)12-16(23-22)13-17(19)20/h7,12,14,16-17,21-22H,1,8-11,13H2,2-6H3/t14-,16-,17+,18-,19+,20+/m1/s1

0 references

InChIKey

PUYKSYJUMZVGFC-AZQPHWPRSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

PUYKSYJUMZVGFC-AZQPHWPRSA-N

(Q105215344)

(3S)-5-[(1S,2R,4aR,7S,8aR)-7-hydroperoxy-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-1-en-3-ol

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