(Q27135241)

English

neurolenin C

chemical compound

In more languages

Statements

type of chemical entity

0 references

germacrane sesquiterpenoid

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0 references

chemical structure

Neurolenin C.svg
525 × 485; 18 KB

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380.184±0 dalton

1 reference

language of work or name

Neurolenin C (English)

7 October 2016

stereoisomer of

[(3aR,4S,5R,6R,8Z,10R,11aR)-4,6-dihydroxy-6,10-dimethyl-3-methylidene-2,7-dioxo-3a,4,5,10,11,11a-hexahydrocyclodeca[b]furan-5-yl] 3-methylbutanoate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

[(3aS,4S,5R,6R,8Z,10R,11aR)-4,6-dihydroxy-6,10-dimethyl-3-methylidene-2,7-dioxo-3a,4,5,10,11,11a-hexahydrocyclodeca[b]furan-5-yl] 3-methylbutanoate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₈O₇

1 reference

language of work or name

Neurolenin C (English)

7 October 2016

canonical SMILES

CC1CC2C(C(C(C(C(=O)C=C1)(C)O)OC(=O)CC(C)C)O)C(=C)C(=O)O2

1 reference

language of work or name

Neurolenin C (English)

7 October 2016

isomeric SMILES

C[C@@H]/1C[C@@H]2[C@@H]([C@@H]([C@H]([C@](C(=O)/C=C1)(C)O)OC(=O)CC(C)C)O)C(=C)C(=O)O2

1 reference

language of work or name

Neurolenin C (English)

7 October 2016

Neurolaena lobata

6 references

Quantification of sesquiterpene lactones in leaves ofNeurolaena lobata

Antiprotozoal activity of Neurolaena lobata

Sesquiterpene lactones from Neurolaena lobata

Sesquiterpene lactones in Neurolaena lobata from Costa Rica

Variability of sesquiterpene lactones in Neurolaena lobata of different origin

Antiplasmodial activities and cytotoxic effects of aqueous extracts and sesquiterpene lactones from Neurolaena lobata

Neurolaena oaxacana

1 reference

Sesquiterpene lactones from Neurolaena lobata

Identifiers

InChI=1S/C20H28O7/c1-10(2)8-15(22)27-18-17(23)16-12(4)19(24)26-13(16)9-11(3)6-7-14(21)20(18,5)25/h6-7,10-11,13,16-18,23,25H,4,8-9H2,1-3,5H3/b7-6-/t11-,13+,16-,17-,18+,20+/m0/s1

1 reference

language of work or name

Neurolenin C (English)

7 October 2016

PBRMNFXOHFGVPZ-HVACLVPVSA-N

2 references

language of work or name

Neurolenin C (English)

7 October 2016

ChEBI release 2020-09-01

1 reference

language of work or name

(3aR,4S,5R,6S,8Z,10R,11aR)-4,6-Dihydroxy-6,10-dimethyl-3-methylene-2,7-dioxo-2,3,3a,4,5,6,7,10,11,11a-decahydrocyclodeca[b]furan-5-yl 3-methylbutanoate (English)

7 October 2016

2 references

language of work or name

Neurolenin C (English)

7 October 2016

matched by identifier from

PBRMNFXOHFGVPZ-HVACLVPVSA-N

Reaxys registry number

7314386

1 reference

language of work or name

neurolenin C (English)

7 October 2016

mapping relation type

2 references

language of work or name

neurolenin C (English)

7 October 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C20H28O7/c1-10(2)8-15(22)27-18-17(23)16-12(4)19(24)26-13(16)9-11(3)6-7-14(21)20(18,5)25/h6-7,10-11,13,16-18,23,25H,4,8-9H2,1-3,5H3/b7-6-/t11-,13+,16-,17-,18+,20+/m0/s1

UniChem compound ID

1 reference

1 reference

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

15 April 2024

PBRMNFXOHFGVPZ-HVACLVPVSA-N

based on heuristic

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