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Gibberellin A87

Properties

Image

Occurences in reactions

MNX_ID

MNXM126036

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

formula

C₁₉H₂₂O₇

charge

mass

362.13655

reference

InChIKey

DBCALXGMWSCZIP-UHFFFAOYSA-N

InChI

InChI=1S/C19H22O7/c1-8-6-17-7-18(8,25)11(21)5-9(17)19-4-3-10(20)16(2,15(24)26-19)13(19)12(17)14(22)23/h3-4,9-13,20-21,25H,1,5-7H2,2H3,(H,22,23)

SMILES

C=C1CC23CC1(O)C(O)CC2C12C=CC(O)C(C)(C(=O)O1)C2C3C(=O)O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:175645 chebi:175645	Gibberellin A87 4,5,12-trihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadec-13-ene-9-carboxylic acid
hmdb:HMDB0039239	Gibberellin A87 (1R,2R,4S,5S,8S,9S,10R,11S,12S)-4,5,12-trihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1^{5,8}.0^{1,10}.0^{2,8}]heptadec-13-ene-9-carboxylic acid GA87
hmdb:HMDB39239	secondary/obsolete/fantasy identifier