(Q27136061)

English

isoceanothic acid

chemical compound

In more languages

Statements

type of chemical entity

0 references

chemical compound

0 references

486.334525±0 dalton

1 reference

language of work or name

CHEBI:67592 (English)

7 October 2016

stereoisomer of

(1R,2R,5S,8R,9R,10S,13S,14R,15S,16R,18S)-16-hydroxy-1,2,14,17,17-pentamethyl-8-prop-1-en-2-ylpentacyclo[11.7.0.02,10.05,9.014,18]icosane-5,15-dicarboxylic acid

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1R,2R,5S,8R,9R,10R,13S,14R,15R,16S,18R)-16-hydroxy-1,2,14,17,17-pentamethyl-8-prop-1-en-2-ylpentacyclo[11.7.0.02,10.05,9.014,18]icosane-5,15-dicarboxylic acid

1 reference

based on heuristic

inferred from InChI

(1R,2R,5S,8R,9S,10R,13R,14R,15R,16S,18R)-16-hydroxy-1,2,14,17,17-pentamethyl-8-prop-1-en-2-ylpentacyclo[11.7.0.02,10.05,9.014,18]icosane-5,15-dicarboxylic acid

1 reference

based on heuristic

inferred from InChI

Epiceanothic Acid

1 reference

based on heuristic

inferred from InChI

1 reference

based on heuristic

inferred from InChI

(1R,2R,5R,8R,9R,10S,13R,14S,15R,16S,18R)-16-hydroxy-1,2,14,17,17-pentamethyl-8-prop-1-en-2-ylpentacyclo[11.7.0.02,10.05,9.014,18]icosane-5,15-dicarboxylic acid

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₀H₄₆O₅

1 reference

language of work or name

CHEBI:67592 (English)

7 October 2016

canonical SMILES

CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(C(C(C5(C)C)O)C(=O)O)C)C)C(=O)O

1 reference

language of work or name

CHEBI:67592 (English)

7 October 2016

isomeric SMILES

CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@H]4[C@]([C@@]3(CC2)C)(CC[C@@H]5[C@@]4([C@@H]([C@H](C5(C)C)O)C(=O)O)C)C)C(=O)O

1 reference

language of work or name

CHEBI:67592 (English)

7 October 2016

Ceanothus velutinus

1 reference

Constituents of the leaves and root bark of ceanothus velutinus

Breynia fruticosa

1 reference

Triterpene and sterol derivatives from the roots of Breynia fruticosa

Identifiers

InChI=1S/C30H46O5/c1-16(2)17-10-13-30(25(34)35)15-14-27(5)18(21(17)30)8-9-20-28(27,6)12-11-19-26(3,4)23(31)22(24(32)33)29(19,20)7/h17-23,31H,1,8-15H2,2-7H3,(H,32,33)(H,34,35)/t17-,18+,19-,20-,21+,22-,23+,27+,28+,29-,30-/m0/s1

1 reference

language of work or name

CHEBI:67592 (English)

7 October 2016

WLCHQSHZHFLMJH-OHVPXIODSA-N

2 references

language of work or name

CHEBI:67592 (English)

7 October 2016

ChEBI release 2020-09-01

CAS Registry Number

2 references

language of work or name

isoceanothic acid (English)

7 October 2016

WLCHQSHZHFLMJH-OHVPXIODSA-N

CAS Common Chemistry

10 April 2021

https://commonchemistry.cas.org/detail?cas_rn=2739-72-2

1 reference

language of work or name

(1S,2R,3aR,5aR,5bR,7aS,10R,10aR,10bR,12aR,12bR)-2-Hydroxy-10-isopropenyl-3,3,5a,5b,12b-pentamethyloctadecahydrodicyclopenta[a,i]phenanthrene-1,7a(1H)-dicarboxylic acid (English)

7 October 2016

1 reference

language of work or name

CHEBI:67592 (English)

7 October 2016

Reaxys registry number

2713499

1 reference

language of work or name

isoceanothic acid (English)

7 October 2016

mapping relation type

1 reference

language of work or name

isoceanothic acid (English)

7 October 2016

UniChem compound ID

1 reference

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)

Retrieved from "https://www.wikidata.org/w/index.php?title=Q27136061&oldid=2128722511"