(Q27135115)

English

sinularolide E

chemical compound

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No label defined

No description defined

Statements

type of chemical entity

0 references

1 reference

based on heuristic

inferred from SMILES

332.199±0 dalton

1 reference

language of work or name

CHEBI:66510 (English)

7 October 2016

stereoisomer of

(1R,3R,5R,8E,12E,14S,15R)-14-hydroxy-5,9,13-trimethyl-18-methylidene-4,16-dioxatricyclo[13.3.0.03,5]octadeca-8,12-dien-17-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

Lobophytolide D

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1R,3S,5R,12E,14S,15R)-14-hydroxy-5,9,13-trimethyl-18-methylidene-4,16-dioxatricyclo[13.3.0.03,5]octadeca-8,12-dien-17-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1R,3S,5R,8E,12E,14S,15R)-14-hydroxy-5,9,13-trimethyl-18-methylidene-4,16-dioxatricyclo[13.3.0.0³,⁵]octadeca-8,12-dien-17-one

1 reference

based on heuristic

inferred from InChI

(1R,3R,5R,8Z,12E,14R,15R)-14-hydroxy-5,9,13-trimethyl-18-methylidene-4,16-dioxatricyclo[13.3.0.03,5]octadeca-8,12-dien-17-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₈O₄

1 reference

language of work or name

CHEBI:66510 (English)

7 October 2016

canonical SMILES

CC1=CCCC2(C(O2)CC3C(C(C(=CCC1)C)O)OC(=O)C3=C)C

1 reference

language of work or name

CHEBI:66510 (English)

7 October 2016

isomeric SMILES

C/C/1=C\CC[C@@]2([C@@H](O2)C[C@H]3[C@H]([C@@H](/C(=C/CC1)/C)O)OC(=O)C3=C)C

1 reference

language of work or name

CHEBI:66510 (English)

7 October 2016

Identifiers

InChI=1S/C20H28O4/c1-12-7-5-9-13(2)17(21)18-15(14(3)19(22)23-18)11-16-20(4,24-16)10-6-8-12/h8-9,15-18,21H,3,5-7,10-11H2,1-2,4H3/b12-8+,13-9+/t15-,16+,17-,18-,20-/m1/s1

1 reference

language of work or name

CHEBI:66510 (English)

7 October 2016

HVJGVUTXXJGUKC-BGRHJSJQSA-N

2 references

language of work or name

CHEBI:66510 (English)

7 October 2016

ChEBI release 2020-09-01

1 reference

language of work or name

(1aR,4E,8E,10R,10aR,13aR,14aS)-10-Hydroxy-1a,5,9-trimethyl-13-methylene-2,3,6,7,10,10a,13,13a,14,14a-decahydrooxireno[4,5]cyclotetradeca[1,2-b]furan-12(1aH)-one (English)

7 October 2016

2 references

language of work or name

CHEBI:66510 (English)

7 October 2016

matched by identifier from

HVJGVUTXXJGUKC-BGRHJSJQSA-N

mapping relation type

2 references

language of work or name

sinularolide E (English)

7 October 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C20H28O4/c1-12-7-5-9-13(2)17(21)18-15(14(3)19(22)23-18)11-16-20(4,24-16)10-6-8-12/h8-9,15-18,21H,3,5-7,10-11H2,1-2,4H3/b12-8+,13-9+/t15-,16+,17-,18-,20-/m1/s1

UniChem compound ID

1 reference

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