IMPPAT Phytochemical information:
Gibberellin A24
Summary
IMPPAT Phytochemical identifier: IMPHY008727
Phytochemical name: Gibberellin A24
Synonymous chemical names:gibberellin ga24
External chemical identifiers:CID:443454, ChEBI:32906, ZINC:ZINC000004102244, SureChEMBL:SCHEMBL20604588
Chemical structure information
SMILES:
O=C[C@]12CCC[C@@]([C@H]2[C@@H]([C@@]23[C@H]1CC[C@H](C3)C(=C)C2)C(=O)O)(C)C(=O)OInChI:
InChI=1S/C20H26O5/c1-11-8-20-9-12(11)4-5-13(20)19(10-21)7-3-6-18(2,17(24)25)15(19)14(20)16(22)23/h10,12-15H,1,3-9H2,2H3,(H,22,23)(H,24,25)/t12-,13+,14-,15-,18-,19-,20+/m1/s1InChIKey:
QQRSSHFHXYSOMF-CXXOJBQZSA-NDeepSMILES:
O=C[C@@]CCC[C@@][C@H]6[C@@H][C@][C@H]9CC[C@H]C6)C=C)C7)))))))C=O)O))))C)C=O)OFunctional groups:
C=C(C)C, CC(=O)O, CC=O
Molecular scaffolds
Scaffold Graph/Node/Bond level:
C=C1CC23CC1CCC2C1CCCCC1C3Scaffold Graph/Node level:
CC1CC23CC1CCC2C1CCCCC1C3Scaffold Graph level:
CC1CC23CC1CCC2C1CCCCC1C3
Chemical classification
ClassyFire Kingdom: Organic compoundsClassyFire Superclass: Lipids and lipid-like moleculesClassyFire Class: Prenol lipids
ClassyFire Subclass: Diterpenoids
NP Classifier Biosynthetic pathway: Terpenoids
NP Classifier Superclass: Diterpenoids
NP Classifier Class: Gibberellins
NP-Likeness score: 3.162
Chemical structure download