(Q27134325)

English

(4betaH)-5alpha-hydroxy-8alpha-(2-methylbut-2-enoyloxy)-2-oxo-1(10),11(13)-guaiadien-12,6alpha-olide

chemical compound

In more languages

Statements

type of chemical entity

0 references

guaiane sesquiterpenoid

0 references

360.157±0 dalton

1 reference

language of work or name

CHEBI:65832 (English)

7 October 2016

chemical formula

C₂₀H₂₄O₆

1 reference

language of work or name

CHEBI:65832 (English)

7 October 2016

canonical SMILES

CC=C(C)C(=O)OC1CC(=C2C(=O)CC(C2(C3C1C(=C)C(=O)O3)O)C)C

1 reference

language of work or name

CHEBI:65832 (English)

7 October 2016

isomeric SMILES

C/C=C(\C)/C(=O)O[C@H]1CC(=C2C(=O)C[C@H]([C@@]2([C@@H]3[C@@H]1C(=C)C(=O)O3)O)C)C

1 reference

language of work or name

CHEBI:65832 (English)

7 October 2016

Elephantopus mollis

1 reference

Further cytotoxic sesquiterpene lactones from Elephantopus mollis KUNTH.

Identifiers

InChI=1S/C20H24O6/c1-6-9(2)18(22)25-14-7-10(3)16-13(21)8-11(4)20(16,24)17-15(14)12(5)19(23)26-17/h6,11,14-15,17,24H,5,7-8H2,1-4H3/b9-6+/t11-,14+,15-,17+,20-/m1/s1

1 reference

language of work or name

CHEBI:65832 (English)

7 October 2016

SKWQNPANRJEPQJ-JTOVZCNQSA-N

2 references

language of work or name

CHEBI:65832 (English)

7 October 2016

ChEBI release 2020-09-01

CAS Registry Number

2 references

language of work or name

(4betaH)-5alpha-hydroxy-8alpha-(2-methylbut-2-enoyloxy)-2-oxo-1(10),11(13)-guaiadien-12,6alpha-olide (English)

7 October 2016

SKWQNPANRJEPQJ-JTOVZCNQSA-N

CAS Common Chemistry

8 April 2021

https://commonchemistry.cas.org/detail?cas_rn=1039025-72-3

1 reference

language of work or name

(3aR,4S,9R,9aR,9bS)-9a-Hydroxy-6,9-dimethyl-3-methylene-2,7-dioxo-2,3,3a,4,5,7,8,9,9a,9b-decahydroazuleno[4,5-b]furan-4-yl (2E)-2-methyl-2-butenoate (English)

7 October 2016

1 reference

language of work or name

CHEBI:65832 (English)

7 October 2016

Reaxys registry number

18556305

1 reference

language of work or name

(4betaH)-5alpha-hydroxy-8alpha-(2-methylbut-2-enoyloxy)-2-oxo-1(10),11(13)-guaiadien-12,6alpha-olide (English)

7 October 2016

mapping relation type

2 references

language of work or name

(4betaH)-5alpha-hydroxy-8alpha-(2-methylbut-2-enoyloxy)-2-oxo-1(10),11(13)-guaiadien-12,6alpha-olide (English)

7 October 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C20H24O6/c1-6-9(2)18(22)25-14-7-10(3)16-13(21)8-11(4)20(16,24)17-15(14)12(5)19(23)26-17/h6,11,14-15,17,24H,5,7-8H2,1-4H3/b9-6+/t11-,14+,15-,17+,20-/m1/s1

UniChem compound ID

1 reference

DSSTox substance ID

DTXSID301100412

1 reference

matched by identifier from

SKWQNPANRJEPQJ-JTOVZCNQSA-N

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