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(5x,6x)-5,6-Epoxyergosta-7,22-dien-3-ol

Properties

Image

Occurences in reactions

MNX_ID

MNXM115184

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

formula

C₂₈H₄₄O₂

charge

mass

412.33413

reference

chebi:168418

InChIKey

KVMYKLHJBYIOKD-BQYQJAHWSA-N

InChI

InChI=1S/C28H44O2/c1-17(2)18(3)7-8-19(4)22-9-10-23-21-15-25-28(30-25)16-20(29)11-14-27(28,6)24(21)12-13-26(22,23)5/h7-8,15,17-20,22-25,29H,9-14,16H2,1-6H3/b8-7+

SMILES

CC(C)C(C)/C=C/C(C)C1CCC2C3=CC4OC45CC(O)CCC5(C)C3CCC21C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:168418 chebi:168418	(5x,6x)-5,6-Epoxyergosta-7,22-dien-3-ol 15-[(E)-5,6-dimethylhept-3-en-2-yl]-2,16-dimethyl-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadec-10-en-5-ol
hmdb:HMDB0033421	(5x,6x)-5,6-Epoxyergosta-7,22-dien-3-ol 15-[(3E)-5,6-dimethylhept-3-en-2-yl]-2,16-dimethyl-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadec-10-en-5-ol
hmdb:HMDB33421	secondary/obsolete/fantasy identifier