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(3beta,5alpha)-Ergosta-7,23-dien-3-ol

Properties

Image

Occurences in reactions

MNX_ID

MNXM115099

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

formula

C₂₈H₄₆O

charge

mass

398.35487

reference

chebi:175190

InChIKey

KAQGTARNAVQLMK-FBCYGCLPSA-N

InChI

InChI=1S/C28H46O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7,10,18,20-22,24-26,29H,8-9,11-17H2,1-6H3/b19-7+

SMILES

C/C(=C\CC(C)C1CCC2C3=CCC4CC(O)CCC4(C)C3CCC21C)C(C)C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:175190 chebi:175190	(3beta,5alpha)-Ergosta-7,23-dien-3-ol 17-[(E)-5,6-dimethylhept-4-en-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
hmdb:HMDB0029316	(3beta,5alpha)-Ergosta-7,23-dien-3-ol (3b,5a)-Ergosta-7,23-dien-3-ol (3beta,5alpha)-ergosta-7,23-dien-3-ol 14-[(4E)-5,6-dimethylhept-4-en-2-yl]-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-9-en-5-ol
hmdb:HMDB29316	secondary/obsolete/fantasy identifier