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(3beta,11alpha,13beta)-3,11,13-Oleananetriol

Properties

Image

Occurences in reactions

MNX_ID

MNXM115064

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

formula

C₃₀H₅₂O₃

charge

mass

460.39165

reference

chebi:168506

InChIKey

PVMLWBWORNCCPQ-UHFFFAOYSA-N

InChI

InChI=1S/C30H52O3/c1-24(2)13-14-26(5)15-16-29(8)28(7)12-9-20-25(3,4)22(32)10-11-27(20,6)23(28)19(31)17-30(29,33)21(26)18-24/h19-23,31-33H,9-18H2,1-8H3

SMILES

CC1(C)CCC2(C)CCC3(C)C4(C)CCC5C(C)(C)C(O)CCC5(C)C4C(O)CC3(O)C2C1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:168506 chebi:168506	(3beta,11alpha,13beta)-3,11,13-Oleananetriol 4,4,6a,6b,8a,11,11,14b-octamethyl-2,3,4a,5,6,7,8,9,10,12,12a,13,14,14a-tetradecahydro-1H-picene-3,6a,14-triol
hmdb:HMDB0034521	(3beta,11alpha,13beta)-3,11,13-Oleananetriol (3b,11a,13b)-3,11,13-Oleananetriol (3beta,11alpha,13beta)-3,11,13-oleananetriol 4,4,6a,6b,8a,11,11,14b-octamethyl-docosahydropicene-3,12b,14-triol 4,4,6a,6b,8a,11,11,14b-octamethyl-tetradecahydro-1H-picene-3,12b,14-triol
hmdb:HMDB34521	secondary/obsolete/fantasy identifier