(Q104977002)

English

ethyl 2-[(1S,3R,6R,10E,14S)-6-hydroxy-6,14-dimethyl-7-oxo-15-oxabicyclo[12.1.0]pentadec-10-en-3-yl]prop-2-enoate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

Ethyl 2-(6-hydroxy-6,14-dimethyl-7-oxo-15-oxabicyclo[12.1.0]pentadec-10-en-3-yl)prop-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

364.224974124 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₃₂O₅

0 references

canonical SMILES

O=C(OCC)C(=C)C1CCC(O)(C(=O)CCC=CCCC2(OC2C1)C)C

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isomeric SMILES

C=C(C(=O)OCC)[C@@H]1CC[C@@](C)(O)C(=O)CC/C=C/CC[C@]2(C)O[C@H]2C1

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found in taxon

Sinularia flexibilis

1 reference

stated in

Sinulaflexiolides A-K, cembrane-type diterpenoids from the chinese soft coral Sinularia flexibilis

Identifiers

InChI

InChI=1S/C21H32O5/c1-5-25-19(23)15(2)16-11-13-20(3,24)17(22)10-8-6-7-9-12-21(4)18(14-16)26-21/h6-7,16,18,24H,2,5,8-14H2,1,3-4H3/b7-6+/t16-,18+,20-,21+/m1/s1

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InChIKey

DDYTYSVCDPIUID-UWQKZCFLSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

DDYTYSVCDPIUID-UWQKZCFLSA-N

(Q104977002)

ethyl 2-[(1S,3R,6R,10E,14S)-6-hydroxy-6,14-dimethyl-7-oxo-15-oxabicyclo[12.1.0]pentadec-10-en-3-yl]prop-2-enoate

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Identifiers

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