(Q27158947)

CHEBI:86165 (English)

9 October 2016

chemical formula

C₂₇H₄₆O₃

1 reference

CHEBI:86165 (English)

9 October 2016

canonical SMILES

CC(CCC(C(C)CO)O)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C

1 reference

CHEBI:86165 (English)

9 October 2016

isomeric SMILES

C[C@H](CC[C@@H]([C@@H](C)CO)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C

1 reference

CHEBI:86165 (English)

InChI=1S/C27H46O3/c1-17(5-10-25(30)18(2)16-28)22-8-9-23-21-7-6-19-15-20(29)11-13-26(19,3)24(21)12-14-27(22,23)4/h6,17-18,20-25,28-30H,5,7-16H2,1-4H3/t17-,18+,20+,21+,22-,23+,24+,25+,26+,27-/m1/s1

9 October 2016

Identifiers

InChI

1 reference

CHEBI:86165 (English)

XMULUVSUDUCTFU-QDKHZERXSA-N

9 October 2016

InChIKey

2 references

CHEBI:86165 (English)

9 October 2016

stated in

ChEBI release 2020-09-01

2 references

CHEBI:86165 (English)

matched by identifier from

9 October 2016

InChIKey

XMULUVSUDUCTFU-QDKHZERXSA-N

ChEBI ID

86165

mapping relation type

2 references

(24S,25S)-cholest-5-en-3beta,24,26-triol (English)

matched by identifier from

9 October 2016

International Chemical Identifier

InChI

InChI=1S/C27H46O3/c1-17(5-10-25(30)18(2)16-28)22-8-9-23-21-7-6-19-15-20(29)11-13-26(19,3)24(21)12-14-27(22,23)4/h6,17-18,20-25,28-30H,5,7-16H2,1-4H3/t17-,18+,20+,21+,22-,23+,24+,25+,26+,27-/m1/s1

1 reference

2 references

https://www.swisslipids.org/#/downloads