(Q110189859)

English

2-[(E)-4-[(1S,3'R,4aR,7aR)-3'-methoxy-2',2',4a,7a-tetramethylspiro[6,7-dihydro-5H-cyclopenta[c]pyran-1,5'-oxolane]-3-yl]-3-methylbut-2-enyl]-6-methylcyclohexa-2,5-diene-1,4-dione

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

2-(4-{4'-methoxy-4a,5',5',7a-tetramethyl-6,7-dihydro-5H-spiro[cyclopenta[c]pyran-1,2'-oxolan]-3-yl}-3-methylbut-2-en-1-yl)-6-methylcyclohexa-2,5-diene-1,4-dione

1 reference

based on heuristic

inferred from SMILES

mass

454.271924316 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(7S,11S,12S,14R)-14-methoxyamentol quinone

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₈H₃₈O₅

0 references

canonical SMILES

O=C1C=C(C(=O)C(=C1)CC=C(C)CC=2OC3(OC(C)(C)C(OC)C3)C4(C)CCCC4(C2)C)C

0 references

isomeric SMILES

CO[C@@H]1C[C@]2(OC(C/C(C)=C/CC3=CC(=O)C=C(C)C3=O)=C[C@@]3(C)CCC[C@@]23C)OC1(C)C

0 references

found in taxon

Cystophora fibrosa

1 reference

stated in

Tetraprenyltoluquinols from the brown alga Cystophora fibrosa.

Identifiers

InChI

InChI=1S/C28H38O5/c1-18(9-10-20-15-21(29)14-19(2)24(20)30)13-22-16-26(5)11-8-12-27(26,6)28(32-22)17-23(31-7)25(3,4)33-28/h9,14-16,23H,8,10-13,17H2,1-7H3/b18-9+/t23-,26-,27-,28+/m1/s1

0 references

InChIKey

SDQLKXJANFVKTM-RFHHCZQXSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

SDQLKXJANFVKTM-RFHHCZQXSA-N

(Q110189859)

2-[(E)-4-[(1S,3'R,4aR,7aR)-3'-methoxy-2',2',4a,7a-tetramethylspiro[6,7-dihydro-5H-cyclopenta[c]pyran-1,5'-oxolane]-3-yl]-3-methylbut-2-enyl]-6-methylcyclohexa-2,5-diene-1,4-dione

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