LOBETYOLIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H28O8
Molecular Weight	396.4315
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)(\C=C\CCCO)[C@H](O)C#CC#C\C=C\C

InChI

InChIKey=MMMUDYVKKPDZHS-MXFZCOKBSA-N

InChI=1S/C20H28O8/c1-2-3-4-5-7-10-14(23)15(11-8-6-9-12-21)27-20-19(26)18(25)17(24)16(13-22)28-20/h2-3,8,11,14-26H,6,9,12-13H2,1H3/b3-2+,11-8+/t14-,15-,16-,17-,18+,19-,20-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C20H28O8
Molecular Weight	396.4315
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	2
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:03:43 GMT 2023` Edited by `admin` on `Sat Dec 16 15:03:43 GMT 2023`
Record UNII	YJZ71TRO1X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

LOBETYOLIN

Common Name

English

.BETA.-D-GLUCOPYRANOSIDE, (1R,2R,7E)-2-HYDROXY-1-((1E)-5-HYDROXY-1-PENTENYL)-7-NONENE-3,5-DIYNYL

Systematic Name

English

Code System Code Type Description

CAS

129277-38-9

Created by admin on Sat Dec 16 15:03:43 GMT 2023 , Edited by admin on Sat Dec 16 15:03:43 GMT 2023

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FDA UNII

YJZ71TRO1X

Created by admin on Sat Dec 16 15:03:43 GMT 2023 , Edited by admin on Sat Dec 16 15:03:43 GMT 2023

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PUBCHEM

14655097

Created by admin on Sat Dec 16 15:03:43 GMT 2023 , Edited by admin on Sat Dec 16 15:03:43 GMT 2023

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CODONOPSIS PILOSULA ROOT

PARENT -> CONSTITUENT ALWAYS PRESENT