Gibberellic acid

C₁₉H₂₂O₆CAS 77-06-5346.38 g/mol

Open in Covalent MOL file

Alcohol Alkene Carboxylic acid Ester Lactone

Properties

Molecular formula: C₁₉H₂₂O₆
Molar mass: 346.38 g/mol
Exact mass: 346.1416 Da
Melting point: 234 °C
pKa: 4
Water solubility: 5 g/L (25 °C)
logP: 1.03Crippen estimate
Polar surface area: 104.1 Å²
H-bond donors / acceptors: 3 / 5
Rotatable bonds: 1
Stereocentres: S, S, R, R, S, S, R, Sin SMILES atom order

Hazards

Warning

H319 Causes serious eye irritation61.3% of notifiers
H412 Harmful to aquatic life with long lasting effects41.4% of notifiers

Aggregated from 256 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264+P265, P273, P280, P305+P351+P338, P337+P317, P501

Identifiers

CAS number

77-06-5

SMILES

C=C1C[C@]23C[C@@]1(O)CC[C@H]2[C@@]12C=C[C@H](O)[C@@](C)(C(=O)O1)[C@H]2[C@@H]3C(=O)O

InChIKey

IXORZMNAPKEEDV-OBDJNFEBSA-N

InChI

InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10-,11+,12-,13-,16-,17+,18+,19-/m1/s1

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Type any one amount. The others follow from the molar mass.

Names and synonyms

31 names · show all

Gibb-3-ene-1,10-dicarboxylic acid, 2,4a,7-trihydroxy-1-methyl-8-methylene-, 1,4a-lactone, (1α,2β,4aα,4bβ,10β)-
Gibberellin A3
GA3
GA
Gibberellic acid GA3
Berelex
Gibreskol
Pro-gibb plus
Gibrescol
Pro-gibb
TU 64-3-103-75
(+)-Gibberellin A3
Release LC
RyzUp
Ralex
(+)-Gibberellic acid
Maxon
Maxon (plant growth regulator)
Activol
NSC 14190
NSC 19450
Arbostim
Grocel GA3
GibGro
Gibberellin GA3
Giberllon
Clemencuaje
ProGib
Berelex L
RyzUp SmartGrass
Release

Work with Gibberellic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Steviol471-80-733 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Cynaropicrin35730-78-0 Phytohemagglutinins9008-97-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia