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(3alpha,5alpha,7alpha)-14-Methylergosta-9(11),24(28)-dien-3,7-diol

Properties

Image

Occurences in reactions

MNX_ID

MNXM115031

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

formula

C₂₉H₄₈O₂

charge

mass

428.36543

reference

hmdb:HMDB0041112

InChIKey

XCSSKRDLJIUVCE-UHFFFAOYSA-N

InChI

InChI=1S/C29H48O2/c1-18(2)19(3)8-9-20(4)23-11-15-29(7)26-24(12-14-28(23,29)6)27(5)13-10-22(30)16-21(27)17-25(26)31/h12,18,20-23,25-26,30-31H,3,8-11,13-17H2,1-2,4-7H3

SMILES

C=C(CCC(C)C1CCC2(C)C3C(=CCC12C)C1(C)CCC(O)CC1CC3O)C(C)C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
hmdb:HMDB0041112	(3alpha,5alpha,7alpha)-14-Methylergosta-9(11),24(28)-dien-3,7-diol (3a,5a,7a)-14-Methylergosta-9(11),24(28)-dien-3,7-diol (3alpha,5alpha,7alpha)-14-methylergosta-9(11),24(28)-dien-3,7-diol 2,11,15-trimethyl-14-(6-methyl-5-methylideneheptan-2-yl)tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-1(17)-ene-5,9-diol
hmdb:HMDB41112	secondary/obsolete/fantasy identifier