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3alpha-12-Ursene-3,24-diol

Properties

Image

Occurences in reactions

MNX_ID

MNXM117638

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

formula

C₃₀H₅₀O₂

charge

mass

442.38108

reference

hmdb:HMDB0041145

InChIKey

OWRQLFZZRDBJKV-UHFFFAOYSA-N

InChI

InChI=1S/C30H50O2/c1-19-10-13-26(3)16-17-29(6)21(25(26)20(19)2)8-9-23-27(4)14-12-24(32)28(5,18-31)22(27)11-15-30(23,29)7/h8,19-20,22-25,31-32H,9-18H2,1-7H3

SMILES

CC1CCC2(C)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
hmdb:HMDB0041145	3alpha-12-Ursene-3,24-diol 3a-12-Ursene-3,24-diol 3alpha-12-ursene-3,24-diol 4-(hydroxymethyl)-4,6a,6b,8a,11,12,14b-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-ol 4-(hydroxymethyl)-4,6a,6b,8a,11,12,14b-heptamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol
hmdb:HMDB41145	secondary/obsolete/fantasy identifier