(Q27166280)

BRD-A67438293-001-01-3 (English)

9 October 2016

chemical formula

C₂₂H₃₄O₂

1 reference

BRD-A67438293-001-01-3 (English)

9 October 2016

canonical SMILES

CCCCCC(CCC1C(CC2C1CC3=C(C2)C(=CC=C3)C)O)O

1 reference

BRD-A67438293-001-01-3 (English)

9 October 2016

isomeric SMILES

CCCCC[C@@H](CC[C@H]1[C@@H](CC2C1CC3=C(C2)C(=CC=C3)C)O)O

1 reference

BRD-A67438293-001-01-3 (English)

InChI=1S/C22H34O2/c1-3-4-5-9-18(23)10-11-19-21-12-16-8-6-7-15(2)20(16)13-17(21)14-22(19)24/h6-8,17-19,21-24H,3-5,9-14H2,1-2H3/t17?,18-,19+,21?,22+/m0/s1

9 October 2016

Identifiers

InChI

1 reference

BRD-A67438293-001-01-3 (English)

OLMBOBKKGZYZNU-OYQUQHOHSA-N

9 October 2016

InChIKey

2 references

BRD-A67438293-001-01-3 (English)

9 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(1R,2R)-1-[(3S)-3-Hydroxyoctyl]-5-methyl-2,3,3a,4,9,9a-hexahydro-1H-cyclopenta[b]naphthalen-2-ol (English)

9 October 2016

1 reference

BRD-A67438293-001-01-3 (English)

9 October 2016

ChEBI ID

94422

mapping relation type

1 reference