(Q27138474)

3-[[(1S,2R,4aR,8aS)-1,2,4a-trimethyl-5-methylidene-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl]-2-hydroxy-5-methoxycyclohexa-2,5-diene-1,4-dione

CHEBI:70134 (English)

7 October 2016

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

1 reference

based on heuristic

inferred from InChI

3-[[(1S,2R,4As,8aR)-1,2,4a-trimethyl-5-methylidene-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl]-2-hydroxy-5-methoxycyclohexa-2,5-diene-1,4-dione

1 reference

1 reference

Ilimaquinone-CAS 71678-03-0

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₂H₃₀O₄

1 reference

CHEBI:70134 (English)

7 October 2016

canonical SMILES

CC1CCC2(C(C1(C)CC3=C(C(=O)C=C(C3=O)OC)O)CCCC2=C)C

1 reference

CHEBI:70134 (English)

7 October 2016

isomeric SMILES

C[C@H]1CC[C@@]2([C@H]([C@]1(C)CC3=C(C(=O)C=C(C3=O)OC)O)CCCC2=C)C

1 reference

Promotion of IL-8 production in PMA-stimulated HL-60 cells by sesquiterpene quinones from a marine sponge, Hippospongia sp.

CHEBI:70134 (English)

7 October 2016

1 reference

Fasciospongia turgida

1 reference

New sesquiterpene hydroquinones from a Taiwanese marine sponge Polyfibrospongia australis

Dactylospongia elegans

5 references

Sesquiterpene benzoxazoles and sesquiterpene quinones from the marine sponge Dactylospongia elegans

Dactyloquinones C, D and E novel sesquiterpenoid quinones, from the Okinawan marine sponge, Dactylospongia elegans

Sesquiterpene benzoxazoles and sesquiterpene quinones from the marine sponge Dactylospongia elegans

The structures and stereochemistry of cytotoxic sesquiterpene quinones from dactylospongia elegans

Dactyloquinones A and B, new sesquiterpenoid quinones from the Okinawan marine sponge Dactylospongia elegans

Spongia

1 reference

Isometachromin, a new cytotoxic sesquiterpenoid from a deep water sponge of the family Spongiidae

Dysidea lehnerti

1 reference

New sesquiterpene/quinones from two sponges of the genus Hyrtios

Fenestraspongia

1 reference

5-Epi-Ilimaquinone, a metabolite of the sponge Fenestraspongia sp

Identifiers

InChI

InChI=1S/C22H30O4/c1-13-7-6-8-18-21(13,3)10-9-14(2)22(18,4)12-15-19(24)16(23)11-17(26-5)20(15)25/h11,14,18,24H,1,6-10,12H2,2-5H3/t14-,18+,21-,22+/m0/s1

1 reference

CHEBI:70134 (English)

JJWITJNSXCXULM-UPOGBMBOSA-N

7 October 2016

InChIKey

2 references

CHEBI:70134 (English)

7 October 2016

ChEBI release 2020-09-01

1 reference

4a-epi-Ilimaquinone (English)

7 October 2016

2 references

CHEBI:70134 (English)

matched by identifier from

7 October 2016

InChIKey

JJWITJNSXCXULM-UPOGBMBOSA-N

ChEBI ID

70134

mapping relation type

2 references

5-epi-ilimaquinone (English)

matched by identifier from

7 October 2016

International Chemical Identifier

InChI

InChI=1S/C22H30O4/c1-13-7-6-8-18-21(13,3)10-9-14(2)22(18,4)12-15-19(24)16(23)11-17(26-5)20(15)25/h11,14,18,24H,1,6-10,12H2,2-5H3/t14-,18+,21-,22+/m0/s1

1 reference