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gibberellin A110

MNXM11612 is deprecated and here replaced by MNXM727077
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM727077 Image of MNXM727077
referencechebi:133478
formulaC20H28O5
global charge0
mol weight348.439
InChIKeySFGDEUSMQMGAFH-MJPABCAUSA-N
InChIInChI=1S/C20H28O5/c1-10-6-20-7-11(10)4-5-13(20)18(2)8-12(21)9-19(3,17(24)25)15(18)14(20)16(22)23/h11-15,21H,1,4-9H2,2-3H3,(H,22,23)(H,24,25)/t11-,12+,13+,14-,15+,18+,19-,20+/m1/s1
SMILESC=C1C[C@]23C[C@H]1CC[C@H]2[C@]1(C)C[C@H](O)C[C@@](C)(C(=O)O)[C@H]1[C@@H]3C(=O)O
MNX internals
InChI (mnx)InChI=1/C20H28O5/c1-10-6-20-7-11(10)4-5-13(20)18(2)8-12(21)9-19(3,17(24)25)15(18)14(20)16(22)23/h11-15,21H,1,4-9H2,2-3H3,(H,22,23)(H,24,25)/t11-,12+,13+,14-,15+,18+,19-,20+/m1/s1 Image of MNXM727077
SMILES (mnx)[CH2:1]=[C:10]1[CH2:6][C@:20]23[CH2:7][C@H:11]1[CH2:4][CH2:5][C@H:13]2[C@:18]1([CH3:2])[CH2:8][C@H:12]([OH:21])[CH2:9][C@@:19]([CH3:3])([C:17](=[O:24])[OH:25])[C@H:15]1[C@@H:14]3[C:16](=[O:22])[OH:23]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:133478
chebi:133478
SFGDEUSMQMGAFH-MJPABCAUSA-N 		gibberellin A110
(1alpha,3beta,4aalpha,4bbeta,10beta)-3-hydroxy-1,4a-dimethyl-8-methylidenegibbane-1,10-dicarboxylic acid
GA110

seed.compound:cpd24538
seedM:cpd24538
SFGDEUSMQMGAFH-MJPABCAUSA-L 		GA110
gibberellin A110
hmdb:HMDB0032010
SFGDEUSMQMGAFH-MJPABCAUSA-N 		Gibberellin A110
(1R,2S,3S,4R,6S,8S,9S,12R)-6-hydroxy-4,8-dimethyl-13-methylidenetetracyclo[10.2.1.0^{1,9}.0^{3,8}]pentadecane-2,4-dicarboxylic acid
(1alpha,3beta,4Aalpha,4bbeta,10beta)-3-hydroxy-1,4a-dimethyl-8-methylenegibbane-1,10-dicarboxylic acid
(1alpha,3beta,4aalpha,4bbeta,10beta)-3-hydroxy-1,4a-dimethyl-8-methylenegibbane-1,10-dicarboxylic acid
GA110

metacyc.compound:CPD-475
metacycM:CPD-475
SFGDEUSMQMGAFH-MJPABCAUSA-L 		gibberellin A110
GA110

hmdb:HMDB32010
seedM:M_cpd24538 		secondary/obsolete/fantasy identifier