AJUGOL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H24O9
Molecular Weight	348.3457
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=VELYAQRXBJLJAK-XKKWFBPMSA-N

InChI=1S/C15H24O9/c1-15(21)4-7(17)6-2-3-22-13(9(6)15)24-14-12(20)11(19)10(18)8(5-16)23-14/h2-3,6-14,16-21H,4-5H2,1H3/t6-,7+,8+,9+,10+,11-,12+,13-,14-,15-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C15H24O9
Molecular Weight	348.3457
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	10 / 10
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:33:59 GMT 2023` Edited by `admin` on `Sat Dec 16 09:33:59 GMT 2023`
Record UNII	3W9VFT5UKU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

AJUGOL

Common Name

English

(2S,3S,4R,5R,6S)-6-(((1R,4AS,7S,7AR)-7-HYDROXY-7-METHYL-1,4A,5,6,7,7A-HEXAHYDROCYCLOPENTA(C)PYRAN-1-YL)OXY)-2-(HYDROXYMETHYL)TETRAHYDRO-2H-PYRAN-2,3,4,5-TETRAOL

Systematic Name

English

(1S,4AR,5R,7S,7AS)-1,4A,5,6,7,7A-HEXAHYDRO-5,7-DIHYDROXY-7-METHYLCYCLOPENTA(C)PYRAN-1-YL .BETA.-D-GLUCOPYRANOSIDE

Systematic Name

English

.BETA.-D-GLUCOPYRANOSIDE, 1,4A,5,6,7,7A-HEXAHYDRO-5,7-DIHYDROXY-7-METHYLCYCLOPENTA(C)PYRAN-1-YL, (1S-(1.ALPHA.,4A.ALPHA.,5.ALPHA.,7.ALPHA.,7A.ALPHA.))-

Systematic Name

English

.BETA.-D-GLUCOPYRANOSIDE, (1S,4AR,5R,7S,7AS)-1,4A,5,6,7,7A-HEXAHYDRO-5,7-DIHYDROXY-7-METHYLCYCLOPENTA(C)PYRAN-1-YL

Systematic Name

English

Code System Code Type Description

CAS

52949-83-4

Created by admin on Sat Dec 16 09:33:59 GMT 2023 , Edited by admin on Sat Dec 16 09:33:59 GMT 2023

PRIMARY

PUBCHEM

6325127

Created by admin on Sat Dec 16 09:33:59 GMT 2023 , Edited by admin on Sat Dec 16 09:33:59 GMT 2023

PRIMARY

FDA UNII

3W9VFT5UKU

Created by admin on Sat Dec 16 09:33:59 GMT 2023 , Edited by admin on Sat Dec 16 09:33:59 GMT 2023

PRIMARY

Related Record Type Details


					3W9VFT5UKU

AJUGOL

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