(−)-anisatin (Q105007367)

(1S,2R,4R,5R,6S,7R,8S,11R)-4,5,7,11-tetrahydroxy-2,7-dimethylspiro[9-oxatricyclo[6.3.1.01,5]dodecane-6,3'-oxetane]-2',10-dione

inferred from SMILES

stereoisomer of

1 reference

(1S,2R,4R,5R,6S,7R,8R,11S)-4,5,7,11-tetrahydroxy-2,7-dimethylspiro[9-oxatricyclo[6.3.1.01,5]dodecane-6,3'-oxetane]-2',10-dione

inferred from InChI

1 reference

(1R,2S,4S,5S,6R,7S,8S,11S)-4,5,7,11-tetrahydroxy-2,7-dimethylspiro[9-oxatricyclo[6.3.1.01,5]dodecane-6,3'-oxetane]-2',10-dione

inferred from InChI

2 references

inferred from InChIKey

inferred from InChI

chemical formula

C₁₅H₂₀O₈

0 references

canonical SMILES

O=C1OC2CC3(C1O)C(C)CC(O)C3(O)C4(C(=O)OC4)C2(O)C

0 references

isomeric SMILES

C[C@@H]1C[C@@H](O)[C@@]2(O)[C@@]13C[C@@H](OC(=O)[C@@H]3O)[C@](C)(O)[C@@]21COC1=O

0 references

found in taxon

Illicium anisatum

6 references

New sesqui-neolignan from the pericarps of Illicium macranthum.

On the Toxin of Illicium Anisatum. I. The Isolation and Characterization of a Convulsant Principle: Anisatin1

Anisatin: a Crystallographic, N.M.R. and Theoretical Conformation Study

Combination of TLC and HPLC-MS/MS methods. Approach to a rational quality control of Chinese star anise

Minor constituents from the seeds of Japanese star-anise.

Two sesquiterpene lactones from Illicium anisatum

Illicium floridanum

3 references

New Sesquiterpene Lactones from Illicium floridanum

Two sesquiterpene lactones from Illicium anisatum

Combination of TLC and HPLC-MS/MS methods. Approach to a rational quality control of Chinese star anise

Illicium fargesii

1 reference

Two new sesquiterpenoids and two new prenylated phenylpropanoids from Illicium fargesii, and neuroprotective activity of macranthol

Illicium oligandrum

1 reference

Sesquiterpenoids and phenylpropanoids from pericarps of Illicium oligandrum

Illicium henryi

1 reference

Combination of TLC and HPLC-MS/MS methods. Approach to a rational quality control of Chinese star anise

Illicium lanceolatum

1 reference

Combination of TLC and HPLC-MS/MS methods. Approach to a rational quality control of Chinese star anise

Illicium majus

2 references

Isolation of three new sesquiterpene lactones from the pericarps of Illicium majus.

New anisatin-like sesquitepene lactones from pericarps of illicium majus

Illicium merrillianum

4 references

Merrillianin, a unique seco-prezizaane-type sesquiterpene, and (6R)-pseudomajucin from Illicium merrillianum

Structure and neurotrophic activity of seco-prezizaane-type sesquiterpenes from Illicium merrillianum

Structures of Novel Sesquiterpenes from the Pericarps of Illicium merrillianum.

Three new sesquiterpene lactones from the pericarps of Illicium merrillianum

Illicium micranthum

1 reference

Combination of TLC and HPLC-MS/MS methods. Approach to a rational quality control of Chinese star anise

Illicium simonsii

2 references

Combination of TLC and HPLC-MS/MS methods. Approach to a rational quality control of Chinese star anise

Two new sesquiterpenoids and two new prenylated phenylpropanoids from Illicium fargesii, and neuroprotective activity of macranthol

Illicium verum

2 references

Combination of TLC and HPLC-MS/MS methods. Approach to a rational quality control of Chinese star anise

Neurotropic components from star anise (Illicium verum Hook. fil.)

Commons category

Anisatin

0 references

Identifiers

InChI

InChI=1S/C15H20O8/c1-6-3-7(16)15(21)13(6)4-8(23-10(18)9(13)17)12(2,20)14(15)5-22-11(14)19/h6-9,16-17,20-21H,3-5H2,1-2H3/t6-,7-,8-,9+,12+,13+,14+,15-/m1/s1

0 references

0 references

CAS Registry Number

5230-87-5

1 reference

CAS (formerly Chemical Abstracts Service)

retrieved

25 January 2022

ChemSpider ID

103015

1 reference

imported from Wikimedia project

2 references

17 September 2022

inferred from InChIKey

ChEBI ID

182764

mapping relation type

exact match

1 reference

International Chemical Identifier

InChI

InChI=1S/C15H20O8/c1-6-3-7(16)15(21)13(6)4-8(23-10(18)9(13)17)12(2,20)14(15)5-22-11(14)19/h6-9,16-17,20-21H,3-5H2,1-2H3/t6-,7-,8-,9+,12+,13+,14+,15-/m1/s1

0 references

1 reference

NMRShiftDB structure ID

20176185

1 reference

DSSTox substance ID

DTXSID6058396

2 references

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

DSSTOX compound identifier

0 references

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.208.646

retrieved

27 December 2018

title

[No public or meaningful name is available] (English)

quotation

CAS no.: 5230-87-5 (English)

ECHA Substance Infocard ID

100.208.646

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.208.646

retrieved

27 December 2018

title

[No public or meaningful name is available] (English)

quotation

CAS no.: 5230-87-5 (English)

UNII

W9K8802FZL

1 reference