Gossyrubilone
AlkaPlorer ID: AK075071
Synonym: 6,7-Dihydroxy-2-methyl-5-[[(3-methylbutyl)imino]methyl]-8-(1-methylethyl)-1,4-naphthalenedione, 6,7-Dihydroxy-5-(isobutyliminomethyl)-8-isopropyl-2-methyl-1,4-naphthoquinone
IUPAC Name: 6,7-dihydroxy-2-methyl-5-(3-methylbutyliminomethyl)-8-propan-2-ylnaphthalene-1,4-dione
Structure
SMILES: CC1=CC(=O)C2=C(C=NCCC(C)C)C(O)=C(O)C(C(C)C)=C2C1=O
InChI: InChI=1S/C20H25NO4/c1-10(2)6-7-21-9-13-16-14(22)8-12(5)18(23)17(16)15(11(3)4)20(25)19(13)24/h8-11,24-25H,6-7H2,1-5H3
InChIKey: UYIGQGYXLRGUGA-UHFFFAOYSA-N
Reference
Sesquiterpenoid aldehyde quinones and derivatives in pigment glands of Gossypium
PubChem CID: 137185909
LOTUS: LTS0106226
COCONUT: CNP0358832
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Gossypium hirsutum | Gossypium | Malvaceae | Malvales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 343.4230000000001
TPSA？: 86.96000000000001
MolLogP？: 4.011500000000004
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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