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alpha-Amyrin acetate

Properties

Image

Occurences in reactions

MNX_ID

MNXM118973

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

formula

C₃₂H₅₂O₂

charge

mass

468.39673

reference

hmdb:HMDB0036658

InChIKey

UDXDFWBZZQHDRO-UHFFFAOYSA-N

InChI

InChI=1S/C32H52O2/c1-20-12-15-29(6)18-19-31(8)23(27(29)21(20)2)10-11-25-30(7)16-14-26(34-22(3)33)28(4,5)24(30)13-17-32(25,31)9/h10,20-21,24-27H,11-19H2,1-9H3

SMILES

CC(=O)OC1CCC2(C)C(CCC3(C)C2CC=C2C4C(C)C(C)CCC4(C)CCC23C)C1(C)C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
hmdb:HMDB0036658	alpha-Amyrin acetate (3beta)-Olean-12-en-3-yl acetate -Amyrenyl acetate 4,4,6a,6b,8a,11,12,14b-Octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-yl acetic acid 4,4,6a,6b,8a,11,12,14b-octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-yl acetate 4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-yl acetate Acetate(3beta)-urs-12-en-3-ol Amyrin acetate Urs-12-en-3beta-ol, acetate a-Amyrin acetate a-Amyrin acetic acid alpha alpha-Amyrin acetic acid alpha-amyrin acetate alpha-amyrin acetic acid beta-Amyrin acetate
hmdb:HMDB36658	secondary/obsolete/fantasy identifier