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Andrographolid

Structure via PubChem · Public domain (PubChem)

EntityQ4759444· pop 10· linked from 5 articles

Andrographolid

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chemische Verbindung

Chemical data

Formula
C20H30O5
Molecular weight
350.4 g/mol
IUPAC name
(3E,4S)-3-[2-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]-4-hydroxyoxolan-2-one
SMILES
C[C@@]12CC[C@H]([C@@]([C@H]1CCC(=C)[C@H]2C/C=C/3\[C@@H](COC3=O)O)(C)CO)O
InChIKey
BOJKULTULYSRAS-OTESTREVSA-N
XLogP
2.2
Polar surface area
87 Ų
H-bond donors
3
H-bond acceptors
5
Formal charge
0

via PubChem

Wikidata facts

Mass
350.2093240599999
Show 6 more facts
canonical SMILES
O=C3OCC(O)C3=CCC1\C(=C)CCC2C(C)(CO)C(O)CCC12C
chemical formula
C₂₀H₃₀O₅
found in taxon
Biancaea decapetala
isomeric SMILES
C[C@@]12CC[C@H]([C@@]([C@H]1CCC(=C)[C@H]2C/C=C/3[C@@H](COC3=O)O)(C)CO)O
has characteristic
bitterness
Sources (3)

via Wikidata · CC0

Gallery (2)