(Q104956083)

English

[(1R,2S,4R,5S,6R,8R,10R,11R)-5-[(3aS,5S,6aS)-3a,4,5,6a-tetrahydrofuro[2,3-b]furan-5-yl]-10-acetyloxy-4,5-dimethylspiro[9-oxatricyclo[6.2.2.01,6]dodecane-11,2'-oxirane]-2-yl] acetate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

[5-(3a,4,5,6a-Tetrahydrofuro[2,3-b]furan-5-yl)-10-acetyloxy-4,5-dimethylspiro[9-oxatricyclo[6.2.2.01,6]dodecane-11,2'-oxirane]-2-yl] acetate

1 reference

1 reference

448.209717984 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₄H₃₂O₈

0 references

canonical SMILES

O=C(OC1OC2CC3C(C)(C4OC5OC=CC5C4)C(C)CC(OC(=O)C)C13C6(OC6)C2)C

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isomeric SMILES

CC(=O)O[C@H]1C[C@@H](C)[C@](C)([C@@H]2C[C@H]3C=CO[C@H]3O2)[C@H]2C[C@@H]3C[C@]4(CO4)[C@]12[C@@H](OC(C)=O)O3

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found in taxon

Scutellaria discolor

1 reference

stated in

Studies on Nepalese Crude Drugs. XXI. On the Diterpenoid Constituents of the Aerial Part of Scutellaria discolor COLEBR.

Scutellaria violacea

1 reference

stated in

Antifungal activity of Neo-clerodane diterpenoids from Scutellaria

Identifiers

InChI

InChI=1S/C24H32O8/c1-12-7-19(29-13(2)25)24-17(22(12,4)18-8-15-5-6-27-20(15)32-18)9-16(10-23(24)11-28-23)31-21(24)30-14(3)26/h5-6,12,15-21H,7-11H2,1-4H3/t12-,15-,16-,17-,18+,19+,20+,21+,22+,23+,24+/m1/s1

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InChIKey

CEUOLEQPGHORRY-TXFJJUHBSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

CEUOLEQPGHORRY-TXFJJUHBSA-N

(Q104956083)

[(1R,2S,4R,5S,6R,8R,10R,11R)-5-[(3aS,5S,6aS)-3a,4,5,6a-tetrahydrofuro[2,3-b]furan-5-yl]-10-acetyloxy-4,5-dimethylspiro[9-oxatricyclo[6.2.2.01,6]dodecane-11,2'-oxirane]-2-yl] acetate

Statements

Identifiers

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