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3beta-3,24-Dihydroxy-9(11),12-oleanadien-30-oic acid

Properties

Image

Occurences in reactions

MNX_ID

MNXM117664

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

formula

C₃₀H₄₆O₄

charge

mass

470.33961

reference

hmdb:HMDB0035252

InChIKey

DHANXHHFIWKYCW-UHFFFAOYSA-N

InChI

InChI=1S/C30H46O4/c1-25-13-14-26(2,24(33)34)17-20(25)19-7-8-22-27(3)11-10-23(32)28(4,18-31)21(27)9-12-30(22,6)29(19,5)16-15-25/h7-8,20-21,23,31-32H,9-18H2,1-6H3,(H,33,34)

SMILES

CC1(C(=O)O)CCC2(C)CCC3(C)C(=CC=C4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
hmdb:HMDB0035252	3beta-3,24-Dihydroxy-9(11),12-oleanadien-30-oic acid 10-Hydroxy-9-(hydroxymethyl)-2,4a,6a,6b,9,12a-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14b-octadecahydropicene-2-carboxylate 10-hydroxy-9-(hydroxymethyl)-2,4a,6a,6b,9,12a-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14b-octadecahydropicene-2-carboxylic acid 10-hydroxy-9-(hydroxymethyl)-2,4a,6a,6b,9,12a-hexamethyl-1,3,4,5,6,7,8,8a,10,11,12,14b-dodecahydropicene-2-carboxylic acid 3b-3,24-Dihydroxy-9(11),12-oleanadien-30-Oate 3b-3,24-Dihydroxy-9(11),12-oleanadien-30-Oic acid 3beta-3,24-Dihydroxy-9(11),12-oleanadien-30-Oate 3beta-3,24-dihydroxy-9(11),12-oleanadien-30-Oate 3beta-3,24-dihydroxy-9(11),12-oleanadien-30-Oic acid
hmdb:HMDB35252	secondary/obsolete/fantasy identifier