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Gibberellin A120

MNXM17970 is deprecated and here replaced by MNXM731845
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM731845 Image of MNXM731845
referencehmdb:HMDB0038013
formulaC19H22O4
global charge0
mol weight314.381
InChIKeyWKDIZCSRKTURDM-PNVLVPIUSA-N
InChIInChI=1S/C19H22O4/c1-10-8-18-9-11(10)4-5-12(18)19-7-3-6-17(2,16(22)23-19)14(19)13(18)15(20)21/h3,7,11-14H,1,4-6,8-9H2,2H3,(H,20,21)/t11-,12-,13-,14-,17-,18+,19?/m1/s1
SMILESC=C1C[C@]23C[C@H]1CC[C@H]2C12C=CC[C@@](C)(C(=O)O1)[C@H]2[C@@H]3C(=O)O
MNX internals
InChI (mnx)InChI=1/C19H22O4/c1-10-8-18-9-11(10)4-5-12(18)19-7-3-6-17(2,16(22)23-19)14(19)13(18)15(20)21/h3,7,11-14H,1,4-6,8-9H2,2H3,(H,20,21)/t11-,12-,13-,14-,17-,18+,19?/m1/s1 Image of MNXM731845
SMILES (mnx)[CH2:1]=[C:10]1[CH2:8][C@:18]23[CH2:9][C@H:11]1[CH2:4][CH2:5][C@H:12]2[C:19]12[CH:7]=[CH:3][CH2:6][C@:17]([CH3:2])([C@H:14]1[C@@H:13]3[C:15](=[O:20])[OH:21])[C:16](=[O:22])[O:23]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
hmdb:HMDB0038013
WKDIZCSRKTURDM-PNVLVPIUSA-N 		Gibberellin A120
(1R,2R,5R,8R,9S,10R,11R)-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
1,2-Didehydro ga9
1,2-Didehydrogibberellin a9
GA120

CHEBI:174282
chebi:174282
WKDIZCSRKTURDM-UHFFFAOYSA-N 		Gibberellin A120
11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadec-13-ene-9-carboxylic acid

hmdb:HMDB38013 		secondary/obsolete/fantasy identifier