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cyclooctat-9-ene-5,7-diol

Properties

Image

Occurences in reactions

MNX_ID

MNXM148175

	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	0

formula

C₂₀H₃₄O₂

charge

mass

306.25588

reference

chebi:141020

InChIKey

PAGWWOOUBKDVRF-NNLKJMRESA-N

InChI

InChI=1S/C20H34O2/c1-12(2)14-6-8-19(4)11-15-13(3)10-17(21)18(15)20(5,22)9-7-16(14)19/h7,12-15,17-18,21-22H,6,8-11H2,1-5H3/b16-7-/t13-,14-,15-,17-,18+,19-,20+/m1/s1

SMILES

CC(C)[C@H]1CC[C@]2(C)C[C@H]3[C@@H]([C@H](O)C[C@H]3C)[C@@](C)(O)C/C=C/12

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:141020 chebi:141020	cyclooctat-9-ene-5,7-diol (1R,3R,3aS,4S,6Z,7R,9aR,10aR)-7-isopropyl-1,4,9a-trimethyl-1,2,3,3a,4,5,7,8,9,9a,10,10a-dodecahydrodicyclopenta[a,d][8]annulene-3,4-diol cyclooctat-9-en-5,7-diol
metacyc.compound:CPD-16668 metacycM:CPD-16668 seed.compound:cpd34092 seedM:cpd34092	cyclooctat-9-en-5,7-diol
seedM:M_cpd34092	secondary/obsolete/fantasy identifier