(Q27160714)

Cholesterol arachidate (English)

9 October 2016

chemical formula

C₄₇H₈₄O₂

1 reference

Cholesterol arachidate (English)

9 October 2016

canonical SMILES

CCCCCCCCCCCCCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C

1 reference

Cholesterol arachidate (English)

9 October 2016

isomeric SMILES

CCCCCCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2(C3CC[C@]4(C(C3CC=C2C1)CCC4[C@H](C)CCCC(C)C)C)C

1 reference

Cholesterol arachidate (English)

InChI=1S/C47H84O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27-45(48)49-40-32-34-46(5)39(36-40)28-29-41-43-31-30-42(38(4)26-24-25-37(2)3)47(43,6)35-33-44(41)46/h28,37-38,40-44H,7-27,29-36H2,1-6H3/t38-,40+,41?,42?,43?,44?,46+,47-/m1/s1

9 October 2016

Identifiers

InChI

1 reference

Cholesterol arachidate (English)

SUOVMGLZSOAHJY-YEYBIBAWSA-N

9 October 2016

InChIKey

2 references

Cholesterol arachidate (English)

reason for deprecated rank

9 October 2016

stated in

ChEBI release 2020-09-01

CAS Registry Number

2573-03-7

applies to other chemical entity

1 reference

CE(20:0) (English)

9 October 2016

1 reference

Cholesterol arachidate (English)

9 October 2016

ChEBI ID

88763

mapping relation type

1 reference