(Q27282108)

inferred from SMILES

mass

432.324±0 dalton

1 reference

Chlorogenin (English)

14 October 2016

2 references

(1'R,2R,2'S,4'S,5R,7'S,8'R,9'S,12'S,13'R,16'S,18'R,19'S)-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosane]-16',19'-diol

inferred from InChI

2 references

1 reference

C₂₇H₄₄O₄

1 reference

Chlorogenin (English)

14 October 2016

canonical SMILES

CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC(C6C5(CCC(C6)O)C)O)C)C)OC1

1 reference

Chlorogenin (English)

14 October 2016

isomeric SMILES

C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4C[C@@H]([C@@H]6[C@@]5(CC[C@@H](C6)O)C)O)C)C)OC1

1 reference

Chlorogenone and neochlorogenone from the unripe fruits of Solanum torvum

Chlorogenin (English)

14 October 2016

1 reference

sisal

1 reference

Barbourgenin, a new steroidal sapogenin from Agave sisalana leaves

Solanum incanum

2 references

STEROIDAL SAPONINS FROM SOLANUM UNGUICULATUM (A.) RICH

STEROIDAL SAPONINS FROM SOLANUM UNGUICULATUM (A.) RICH

Yucca aloifolia

2 references

Steroid sapogenins of the leaves ofYucca aloifolia

Steroid sapogenins of the leaves ofYucca aloifolia

Yucca gloriosa

2 references

A steroid sapogenin of the leaves ofYucca gloriosa

A steroid sapogenin of the leaves ofYucca gloriosa

Agave cantala

1 reference

A spirostanol glycoside from Agave cantala

Agave cocui

1 reference

Steroidal sapogenins from leaves of some species of Agave and Furcraea

Chlorogalum pomeridianum

2 references

Saponins and Sapogenins. III. The Sapogenins Obtained from Chlorogalum Pomeridianum

Saponins and Sapogenins. X. The Isolation of Gitogenin from Chlorogalum Pomeridianum

Solanum bahamense

1 reference

Bahamgenin—a steroidal sapogenin from solanum bahamense

Solanum hirtum

2 references

Sapogenins from Solanum meridense

Chlorogenone and neochlorogenone from the unripe fruits of Solanum torvum

Agave vivipara

1 reference

A spirostanol glycoside from Agave cantala

Solanum chrysotrichum

2 references

Chlorogenone and neochlorogenone from the unripe fruits of Solanum torvum

Steroidal Sapogenins from Solanum scorpioideum

Solanum asperolanatum

2 references

Chlorogenone and neochlorogenone from the unripe fruits of Solanum torvum

Steroidal Sapogenins from Solanum scorpioideum

Identifiers

InChI

InChI=1S/C27H44O4/c1-15-5-10-27(30-14-15)16(2)24-23(31-27)13-20-18-12-22(29)21-11-17(28)6-8-25(21,3)19(18)7-9-26(20,24)4/h15-24,28-29H,5-14H2,1-4H3/t15-,16+,17+,18-,19+,20+,21-,22+,23+,24+,25-,26+,27-/m1/s1

1 reference

Chlorogenin (English)

14 October 2016

1 reference

Global Substance Registration System

Chlorogenin (English)

14 October 2016

1 reference

UNII

K8Z178V1DG

chlorogenin (English)

14 October 2016

1 reference

Chlorogenin (English)

14 October 2016

1 reference

Chlorogenin (English)

14 October 2016

ChEBI ID

188325

mapping relation type

exact match

2 references

ChEBI release 2022-06-13

International Chemical Identifier

InChI

InChI=1S/C27H44O4/c1-15-5-10-27(30-14-15)16(2)24-23(31-27)13-20-18-12-22(29)21-11-17(28)6-8-25(21,3)19(18)7-9-26(20,24)4/h15-24,28-29H,5-14H2,1-4H3/t15-,16+,17+,18-,19+,20+,21-,22+,23+,24+,25-,26+,27-/m1/s1

1 reference

CHLOROGENIN (English)

14 October 2016

2 references

DSSTOX compound identifier

1 reference

0 references

DTXCID501331879

0 references

Human Metabolome Database ID

HMDB0302189

2 references

UNII

K8Z178V1DG

2 references

Global Substance Registration System

UNII

K8Z178V1DG

chlorogenin (English)

14 October 2016

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

1 reference

15 January 2022