(Q105009205)

English

(3Z,6R)-3-[(E)-7-[(2S)-6-hydroxy-2,8-dimethylchromen-2-yl]-4-methylhept-4-enylidene]-6-(2-hydroxypropan-2-yl)oxan-2-one

chemical compound

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instance of

type of chemical entity

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subclass of

3-[7-(6-Hydroxy-2,8-dimethylchromen-2-yl)-4-methylhept-4-enylidene]-6-(2-hydroxypropan-2-yl)oxan-2-one

1 reference

based on heuristic

inferred from SMILES

mass

440.256274252 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₇H₃₆O₅

0 references

canonical SMILES

O=C1OC(CCC1=CCCC(=CCCC2(OC3=C(C=C2)C=C(O)C=C3C)C)C)C(O)(C)C

0 references

isomeric SMILES

C/C(=C\CC[C@@]1(C)C=Cc2cc(O)cc(C)c2O1)CC/C=C1/CC[C@H](C(C)(C)O)OC1=O

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found in taxon

Sargassum sagamianum

1 reference

stated in

Antibacterial Quinone Metabolites from the Brown Alga,Sargassum sagamianum

Identifiers

InChI

InChI=1S/C27H36O5/c1-18(8-6-10-20-11-12-23(26(3,4)30)31-25(20)29)9-7-14-27(5)15-13-21-17-22(28)16-19(2)24(21)32-27/h9-10,13,15-17,23,28,30H,6-8,11-12,14H2,1-5H3/b18-9+,20-10-/t23-,27+/m1/s1

0 references

InChIKey

GITUPEOXSDOPPI-MTOVKNMASA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GITUPEOXSDOPPI-MTOVKNMASA-N

(Q105009205)

(3Z,6R)-3-[(E)-7-[(2S)-6-hydroxy-2,8-dimethylchromen-2-yl]-4-methylhept-4-enylidene]-6-(2-hydroxypropan-2-yl)oxan-2-one

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Identifiers

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