AGNUSIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H26O11
Molecular Weight	466.4352
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12C=CO[C@@H](O[C@]3([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@]1([H])C(COC(=O)C4=CC=C(O)C=C4)=C[C@H]2O

InChI

InChIKey=GLACGTLACKLUJX-QNAXTHAFSA-N

InChI=1S/C22H26O11/c23-8-15-17(26)18(27)19(28)22(32-15)33-21-16-11(7-14(25)13(16)5-6-30-21)9-31-20(29)10-1-3-12(24)4-2-10/h1-7,13-19,21-28H,8-9H2/t13-,14+,15+,16+,17+,18-,19+,21-,22-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C22H26O11
Molecular Weight	466.4352
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 20:38:45 UTC 2023` Edited by `admin` on `Fri Dec 15 20:38:45 UTC 2023`
Record UNII	JB24Q0OT9G
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

AGNUSIDE

Common Name

English

.BETA.-D-GLUCOPYRANOSIDE, 1,4A,5,7A-TETRAHYDRO-5-HYDROXY-7-(((4-HYDROXYBENZOYL)OXY)METHYL)CYCLOPENTA(C)PYRAN-1-YL, (1.ALPHA.,4A.ALPHA.,5.ALPHA.,7A.ALPHA.)-

Common Name

English

AGNOSIDE

Common Name

English

AGNUSIDE [USP-RS]

Common Name

English

(-)-BUDDLEJOSIDE A

Common Name

English

BUDDLEJOSIDE A

Common Name

English

.BETA.-D-GLUCOPYRANOSIDE, (1S,4AR,5S,7AS)-1,4A,5,7A-TETRAHYDRO-5-HYDROXY-7-(((4-HYDROXYBENZOYL)OXY)METHYL)CYCLOPENTA(C)PYRAN-1-YL

Common Name

English

Classification Tree Code System Code

DSLD

2318 (Number of products:5)