(Q105345343)

English

6-[(2S,5S)-2,5-dihydroxy-4,6-dimethyl-7-[(1S,2S,4R,5R)-2,4,5-trimethyl-3,6-dioxabicyclo[3.1.0]hexan-2-yl]hepta-3,6-dien-2-yl]-4-methoxy-3,5-dimethylpyran-2-one

chemical compound

In more languages

default values for all languages

No label defined

No description defined

edit

Statements

instance of

type of chemical entity

0 references

subclass of

6-(2,5-dihydroxy-4,6-dimethyl-7-{2,4,5-trimethyl-3,6-dioxabicyclo[3.1.0]hexan-2-yl}hepta-3,6-dien-2-yl)-4-methoxy-3,5-dimethylpyran-2-one

1 reference

based on heuristic

inferred from SMILES

mass

434.230453428 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

6-[(2S,5R)-2,5-dihydroxy-4,6-dimethyl-7-[(1S,2S,4R,5R)-2,4,5-trimethyl-3,6-dioxabicyclo[3.1.0]hexan-2-yl]hepta-3,6-dien-2-yl]-4-methoxy-3,5-dimethylpyran-2-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₄H₃₄O₇

0 references

canonical SMILES

O=C1OC(=C(C(OC)=C1C)C)C(O)(C=C(C)C(O)C(=CC2(OC(C)C3(OC23)C)C)C)C

0 references

isomeric SMILES

COc1c(C)c([C@@](C)(O)C=C(C)[C@H](O)C(C)=C[C@]2(C)O[C@H](C)[C@@]3(C)O[C@@H]23)oc(=O)c1C

0 references

found in taxon

Penicillium

1 reference

stated in

Penicyrones A and B, an epimeric pair of α-pyrone-type polyketides produced by the marine-derived Penicillium sp.

Identifiers

InChI

InChI=1S/C24H34O7/c1-12(10-22(6,27)19-14(3)18(28-9)15(4)20(26)29-19)17(25)13(2)11-23(7)21-24(8,31-21)16(5)30-23/h10-11,16-17,21,25,27H,1-9H3/t16-,17+,21+,22+,23+,24-/m1/s1

0 references

InChIKey

YAEGHQJYDLCTMR-JKQIFROUSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YAEGHQJYDLCTMR-JKQIFROUSA-N

ChEBI ID

225303

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C24H34O7/c1-12(10-22(6,27)19-14(3)18(28-9)15(4)20(26)29-19)17(25)13(2)11-23(7)21-24(8,31-21)16(5)30-23/h10-11,16-17,21,25,27H,1-9H3/t16-,17+,21+,22+,23+,24-/m1/s1

1 reference

Natural Product Atlas ID

NPA021460

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

YAEGHQJYDLCTMR-JKQIFROUSA-N

(Q105345343)

6-[(2S,5S)-2,5-dihydroxy-4,6-dimethyl-7-[(1S,2S,4R,5R)-2,4,5-trimethyl-3,6-dioxabicyclo[3.1.0]hexan-2-yl]hepta-3,6-dien-2-yl]-4-methoxy-3,5-dimethylpyran-2-one

Statements

Identifiers

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)