(Q105195589)

English

(3S)-5-[(1R,4aS,6R,8aR)-6-bromo-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-ol

chemical compound

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1 reference

5-(6-bromo-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpent-1-en-3-ol

1 reference

based on heuristic

inferred from SMILES

mass

368.171477776 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3S)-5-[(1R,4aS,6R,8aS)-6-bromo-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3R)-5-[(1S,4aS,6R,8aS)-6-bromo-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₃BrO

0 references

canonical SMILES

BrC1CCC2(C)C(C(=C)CCC2C1(C)C)CCC(O)(C=C)C

0 references

isomeric SMILES

C=C[C@@](C)(O)CC[C@@H]1C(=C)CC[C@@H]2C(C)(C)[C@H](Br)CC[C@@]21C

0 references

found in taxon

Aplysia dactylomela

1 reference

stated in

New natural product isolation and comparison of the secondary metabolite content of three distinct samples of the sea hare Aplysia dactylomela from tenerife

Identifiers

InChI

InChI=1S/C20H33BrO/c1-7-19(5,22)12-10-15-14(2)8-9-16-18(3,4)17(21)11-13-20(15,16)6/h7,15-17,22H,1-2,8-13H2,3-6H3/t15-,16-,17-,19-,20-/m1/s1

0 references

InChIKey

OOTTXHPHVJPZLE-UNNPPQAFSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OOTTXHPHVJPZLE-UNNPPQAFSA-N

(Q105195589)

(3S)-5-[(1R,4aS,6R,8aR)-6-bromo-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-ol

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