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gibberellin A51

MNXM54964 is deprecated and here replaced by MNXM1364245
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1364245 Image of MNXM1364245
referencechebi:29599
formulaC19H24O5
global charge0
mol weight332.396
InChIKeyHHDWSDSMWJQURA-MHKXYFPYSA-N
InChIInChI=1S/C19H24O5/c1-9-5-18-6-10(9)3-4-12(18)19-8-11(20)7-17(2,16(23)24-19)14(19)13(18)15(21)22/h10-14,20H,1,3-8H2,2H3,(H,21,22)/t10-,11-,12-,13-,14-,17-,18+,19-/m1/s1
SMILESC=C1C[C@]23C[C@H]1CC[C@H]2[C@@]12C[C@H](O)C[C@@](C)(C(=O)O1)[C@H]2[C@@H]3C(=O)O
MNX internals
InChI (mnx)InChI=1/C19H24O5/c1-9-5-18-6-10(9)3-4-12(18)19-8-11(20)7-17(2,16(23)24-19)14(19)13(18)15(21)22/h10-14,20H,1,3-8H2,2H3,(H,21,22)/t10-,11-,12-,13-,14-,17-,18+,19-/m1/s1 Image of MNXM1364245
SMILES (mnx)[CH2:1]=[C:9]1[CH2:5][C@:18]23[CH2:6][C@H:10]1[CH2:3][CH2:4][C@H:12]2[C@:19]12[CH2:8][C@H:11]([OH:20])[CH2:7][C@:17]([CH3:2])([C@H:14]1[C@@H:13]3[C:15](=[O:21])[OH:22])[C:16](=[O:23])[O:24]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:29599
chebi:29599
HHDWSDSMWJQURA-MHKXYFPYSA-N 		gibberellin A51
(1R,2R,5R,8R,9S,10R,11R,13R)-13-hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1(5,8).0(1,10).0(2,8)]heptadecane-9-carboxylic acid
3beta-hydroxy-1beta-methyl-8-methylidene-13-oxo-4a,1alpha-epoxymethano-4aalpha,4bbeta-gibbane-10beta-carboxylic acid
GA51
Gibberellin A51
hmdb:HMDB0303452
HHDWSDSMWJQURA-UHFFFAOYSA-N 		Gibberellin A40
13-Hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1⁵,⁸.0¹,¹⁰.0²,⁸]heptadecane-9-carboxylate
13-hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1⁵,⁸.0¹,¹⁰.0²,⁸]heptadecane-9-carboxylic acid
GA51
hmdb:HMDB0035041
HHDWSDSMWJQURA-MHKXYFPYSA-N 		Gibberellin A51
(1R,2R,5R,8R,9S,10R,11R,13R)-13-hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1^{5,8}.0^{1,10}.0^{2,8}]heptadecane-9-carboxylic acid
2beta-Hydroxy-GA9
GA51

lipidmaps:LMPR0104170022
lipidmapsM:LMPR0104170022
HHDWSDSMWJQURA-MHKXYFPYSA-N 		Gibberellin A51
3beta-hydroxy-1beta-methyl-8-methylidene-13-oxo-4a,1alpha-epoxymethano-4aalpha,4bbeta-gibbane-10beta-carboxylic acid

hmdb:HMDB35041 		secondary/obsolete/fantasy identifier