(Q27135113)

English

sinularolide C

chemical compound

In more languages

Statements

type of chemical entity

0 references

0 references

348.193674±0 dalton

1 reference

language of work or name

CHEBI:66508 (English)

7 October 2016

stereoisomer of

(1R,3R,5S,8Z,12E,14R,15R)-14-hydroxy-5-(hydroxymethyl)-9,13-dimethyl-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,3R,5S,8E,12E,14R,15R)-14-hydroxy-5-(hydroxymethyl)-9,13-dimethyl-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,3R,5S,8E,12E,14S,15R)-14-hydroxy-5-(hydroxymethyl)-9,13-dimethyl-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

1 reference

based on heuristic

inferred from InChI

(1R,3R,5S,8Z,12E,14S,15R)-14-hydroxy-5-(hydroxymethyl)-9,13-dimethyl-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

C₂₀H₂₈O₅

1 reference

language of work or name

CHEBI:66508 (English)

7 October 2016

canonical SMILES

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

1 reference

language of work or name

CHEBI:66508 (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)CO

1 reference

language of work or name

CHEBI:66508 (English)

7 October 2016

Lobophytum crassum

1 reference

Structural and stereochemical studies of alpha-methylene-gamma-lactone-bearing cembrane diterpenoids from a south china sea soft coral Lobophytum crassum

Identifiers

InChI=1S/C20H28O5/c1-12-6-4-8-13(2)17(22)18-15(14(3)19(23)24-18)10-16-20(11-21,25-16)9-5-7-12/h7-8,15-18,21-22H,3-6,9-11H2,1-2H3/b12-7+,13-8+/t15-,16+,17+,18-,20+/m1/s1

1 reference

language of work or name

CHEBI:66508 (English)

7 October 2016

MULWDJOXRRXULO-HAUURUDMSA-N

2 references

language of work or name

CHEBI:66508 (English)

7 October 2016

ChEBI release 2020-09-01

1 reference

language of work or name

(1aS,4E,8E,10S,10aR,13aR,14aS)-10-Hydroxy-1a-(hydroxymethyl)-5,9-dimethyl-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:66508 (English)

7 October 2016

matched by identifier from

MULWDJOXRRXULO-HAUURUDMSA-N

Reaxys registry number

10725395

1 reference

language of work or name

sinularolide C (English)

7 October 2016

mapping relation type

2 references

language of work or name

sinularolide C (English)

7 October 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C20H28O5/c1-12-6-4-8-13(2)17(22)18-15(14(3)19(23)24-18)10-16-20(11-21,25-16)9-5-7-12/h7-8,15-18,21-22H,3-6,9-11H2,1-2H3/b12-7+,13-8+/t15-,16+,17+,18-,20+/m1/s1

UniChem compound ID

1 reference

Sitelinks

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