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gibberellin A17

MNXM11670 is deprecated and here replaced by MNXM727140
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM727140 Image of MNXM727140
referencechebi:143958
formulaC20H23O7
global charge-3
mol weight375.397
InChIKeyAUKMHZZVLPQAOX-CDNFTCFOSA-K
InChIInChI=1S/C20H26O7/c1-10-8-18-9-19(10,27)7-4-11(18)20(16(25)26)6-3-5-17(2,15(23)24)13(20)12(18)14(21)22/h11-13,27H,1,3-9H2,2H3,(H,21,22)(H,23,24)(H,25,26)/p-3/t11-,12-,13-,17-,18+,19+,20-/m1/s1
SMILESC=C1C[C@]23C[C@@]1(O)CC[C@H]2[C@]1(C(=O)[O-])CCC[C@@](C)(C(=O)[O-])[C@H]1[C@@H]3C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C20H26O7/c1-10-8-18-9-19(10,27)7-4-11(18)20(16(25)26)6-3-5-17(2,15(23)24)13(20)12(18)14(21)22/h11-13,27H,1,3-9H2,2H3,(H,21,22)(H,23,24)(H,25,26)/t11-,12-,13-,17-,18+,19+,20-/m1/s1 Image of MNXM727140
SMILES (mnx)[CH2:1]=[C:10]1[CH2:8][C@:18]23[CH2:9][C@@:19]1([OH:27])[CH2:7][CH2:4][C@H:11]2[C@:20]1([C:16](=[O:25])[OH:26])[CH2:6][CH2:3][CH2:5][C@@:17]([CH3:2])([C:15](=[O:23])[OH:24])[C@H:13]1[C@@H:12]3[C:14](=[O:21])[OH:22]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:143958
chebi:143958
AUKMHZZVLPQAOX-CDNFTCFOSA-K 		gibberellin A17
gibberellin A17(3-)

seed.compound:cpd26561
seedM:cpd26561
AUKMHZZVLPQAOX-CDNFTCFOSA-K 		GA17
gibberellin A17
hmdb:HMDB0036897
AUKMHZZVLPQAOX-CDNFTCFOSA-N 		Gibberellin A17
(1S,2S,3R,4R,8R,9R,12S)-12-hydroxy-4-methyl-13-methylidenetetracyclo[10.2.1.0^{1,9}.0^{3,8}]pentadecane-2,4,8-tricarboxylic acid
(1alpha,4aalpha,4bbeta,10beta)-7-Hydroxy-1-methyl-8-methylenegibbane-1,4a,10-tricarboxylic acid
GA17
Gibberellin 17

CHEBI:24236
chebi:24236
AUKMHZZVLPQAOX-CDNFTCFOSA-N 		gibberellin A17
(1S,2S,3R,4R,8R,9R,12S)-12-hydroxy-4-methyl-13-methylidenetetracyclo[10.2.1.0(1,9).0(3,8)]pentadecane-2,4,8-tricarboxylic acid
7alpha-hydroxy-1beta-methyl-8-methylidene-4aalpha,4bbeta-gibbane-1alpha,4a,10beta-tricarboxylic acid
GA17
gibberellin 17

metacyc.compound:CPD1F-86
metacycM:CPD1F-86
AUKMHZZVLPQAOX-CDNFTCFOSA-K 		gibberellin A17
GA17

lipidmaps:LMPR0104170034
lipidmapsM:LMPR0104170034
AUKMHZZVLPQAOX-CDNFTCFOSA-N 		gibberellin A17
GA17
gibberellin 17

hmdb:HMDB36897
seedM:M_cpd26561 		secondary/obsolete/fantasy identifier