(Q27148275)

CHEBI:79223 (English)

8 October 2016

chemical formula

C₁₅H₂₈O₇

1 reference

CHEBI:79223 (English)

8 October 2016

canonical SMILES

CC1C(CC(C(O1)OC(C)CCCCC(CC(=O)O)O)O)O

1 reference

CHEBI:79223 (English)

8 October 2016

isomeric SMILES

C[C@H]1[C@@H](C[C@H]([C@@H](O1)O[C@H](C)CCCC[C@H](CC(=O)O)O)O)O

1 reference

CHEBI:79223 (English)

InChI=1S/C15H28O7/c1-9(5-3-4-6-11(16)7-14(19)20)21-15-13(18)8-12(17)10(2)22-15/h9-13,15-18H,3-8H2,1-2H3,(H,19,20)/t9-,10+,11-,12-,13-,15-/m1/s1

8 October 2016

Identifiers

InChI

1 reference

CHEBI:79223 (English)

8 October 2016

InChIKey

2 references

CHEBI:79223 (English)

8 October 2016

stated in

ChEBI release 2020-09-01

2 references

bhas#10 (English)

8 October 2016

https://commonchemistry.cas.org/detail?cas_rn=1355682-49-3

8 April 2021

1 reference

(3R,8R)-8-[(3,6-Dideoxy-alpha-L-arabino-hexopyranosyl)oxy]-3-hydroxynonanoic acid (English)

8 October 2016

2 references

CHEBI:79223 (English)

matched by identifier from

8 October 2016

InChIKey

Reaxys registry number

22233403

1 reference

bhas#10 (English)

8 October 2016

mapping relation type

2 references

bhas#10 (English)

matched by identifier from

8 October 2016

International Chemical Identifier

InChI

InChI=1S/C15H28O7/c1-9(5-3-4-6-11(16)7-14(19)20)21-15-13(18)8-12(17)10(2)22-15/h9-13,15-18H,3-8H2,1-2H3,(H,19,20)/t9-,10+,11-,12-,13-,15-/m1/s1

1 reference

1 reference

matched by identifier from

InChIKey

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

1 reference