(Q27108536)

VERNOFLEXUOSIDE (English)

(3aS,6aR,8S,9aR,9bS)-3,6,9-trimethylidene-8-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-2-one

5 October 2016

stereoisomer of

1 reference

based on heuristic

inferred from InChI

(3aS,6aR,8S,9aR,9bS)-3,6,9-trimethylidene-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-2-one

1 reference

based on heuristic

inferred from InChI

(3aS,6aR,8S,9aR,9bR)-3,6,9-trimethylidene-8-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-2-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₁H₂₈O₈

1 reference

VERNOFLEXUOSIDE (English)

20 November 2016

canonical SMILES

C=C1CCC2C(C3C1CC(C3=C)OC4C(C(C(C(O4)CO)O)O)O)OC(=O)C2=C

1 reference

VERNOFLEXUOSIDE (English)

20 November 2016

isomeric SMILES

C=C1CC[C@@H]2[C@@H]([C@@H]3[C@H]1C[C@@H](C3=C)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)OC(=O)C2=C

1 reference

Sesquiterpene lactones from Ainsliaea acerifolia Sch.Bip. and A. dissecta Franch. et Sav.

VERNOFLEXUOSIDE (English)

20 November 2016

2 references

Sesquiterpene lactones from Ainsliaea acerifolia Sch.Bip. and A. dissecta Franch. et Sav.

Brachylaena nereifolia

2 references

Sesquiterpene lactones from the Genus brachylaena

Sesquiterpene lactones from the Genus brachylaena

Crepis sibirica

1 reference

Guaianolides from Crepis crocea

Elephantopus scaber

1 reference

Guaianolide Glucosides from Elephantopus scaber

Ixeris repens

2 references

Sesquiterpene glycosides from Ixeris debilis and Ixeris repens

Sesquiterpene glycosides from Ixeris debilis and Ixeris repens

Lactuca virosa

1 reference

Sesquiterpene Lactones in Tissue Culture of Lactuca virosa

Leontodon cichoraceus

2 references

On the occurrence of glucozaluzanin C in Leontodon cichoraceus and its chemotaxonomic significance

A highly substituted germacranolide from Leontodon cichoraceus

Pertya triloba

2 references

Studies on sesquiterpenes from Macroclinidium trilobum Makino. I.

Studies on sesquiterpenes from Macroclinidium trilobum Makino. I.

Sonchus oleraceus

2 references

Studies on sesquiterpene glycosides from Sonchus oleraceus L.

Studies on sesquiterpene glycosides from Sonchus oleraceus L.

Soroseris hookeriana

2 references

New antimicrobial mono- and sesquiterpenes from Soroseris hookeriana subsp. erysimoides

New antimicrobial mono- and sesquiterpenes from Soroseris hookeriana subsp. erysimoides

Ainsliaea fragrans

1 reference

Complete 1H and 13C data assignments of two new guaianolides isolated from Ainsliaea fragrans

Picris conyzoides

1 reference

Complete NMR spectral assignments of two lactucin-type sesquiterpene lactone glycosides from Picris conyzoides.

Picris rhagadioloides

1 reference

The first guaian-12-oic acid glucopyranosyl ester and other constituents from Picris rhagadioloides (L.) Desf. (Asteraceae).

Taraxacum platycarpum

1 reference

Sesquiterpenoids and phenolics from Taraxacum hondoense.

Hyalis argentea

1 reference

Diterpenes from Hyalis argentea

Ixeris sonchifolia

1 reference

Sesquiterpene lactones from Ixeris sonchifolia

lettuce

1 reference

Sesquiterpene lactones from Lactuca laciniata

Mycelis muralis

1 reference

Minor sesquiterpene lactones from Lactuca virosa

Ainsliaea uniflora

1 reference

Sesquiterpene lactones from Diaspananthus uniflorus (SCH. BIP.) KITAM.

Ixeris japonica

1 reference

Sesquiterpene glycosides from Ixeris debilis and Ixeris repens

Lactuca indica

1 reference

Sesquiterpene lactones from Lactuca laciniata

Lactuca serriola

1 reference

Sesquiterpene lactones from Lactuca laciniata

Identifiers

InChI

InChI=1S/C21H28O8/c1-8-4-5-11-9(2)20(26)29-19(11)15-10(3)13(6-12(8)15)27-21-18(25)17(24)16(23)14(7-22)28-21/h11-19,21-25H,1-7H2/t11-,12-,13-,14 ,15-,16 ,17-,18 ,19-,21 /m0/s1

1 reference

VERNOFLEXUOSIDE (English)

20 November 2016

2 references

VERNOFLEXUOSIDE (English)

20 November 2016

ChEBI release 2020-09-01

CAS Registry Number

57576-33-7

2 references

Global Substance Registration System

UNII

56HA3QTL3C

glucozaluzanin c (English)

20 November 2016

https://commonchemistry.cas.org/detail?cas_rn=57576-33-7

9 April 2021

1 reference

Glucozaluzanin C (English)

20 November 2016

2 references

VERNOFLEXUOSIDE (English)

matched by identifier from

20 November 2016

ChEBI ID

9962

mapping relation type

2 references

VERNOFLEXUOSIDE (English)

matched by identifier from

20 November 2016

International Chemical Identifier

InChI

InChI=1S/C21H28O8/c1-8-4-5-11-9(2)20(26)29-19(11)15-10(3)13(6-12(8)15)27-21-18(25)17(24)16(23)14(7-22)28-21/h11-19,21-25H,1-7H2/t11-,12-,13-,14 ,15-,16 ,17-,18 ,19-,21 /m0/s1

1 reference

DSSTOX compound identifier

VERNOFLEXUOSIDE (English)

20 November 2016

1 reference

0 references

0 references

0 references

1 reference

Global Substance Registration System

Vernoflexuoside (English)

5 October 2016

2 references

UNII

56HA3QTL3C

glucozaluzanin c (English)

matched by identifier from

20 November 2016

1 reference

Vernoflexuoside (English)