Adenostemmoic acid C

Adenostemmoic acid C · (16S)-11β,15β,16,17-Tetrahydroxykauran-18-oic acid · Kauran-18-oic acid, 11,15,16,17-tetrahydroxy-, (4α,11β,15β,16α)- (9CI)

Identifikatoren & physikalische Daten

CAS No.	130217-18-4
Summenformel	C20H32O6
Durchschnittliche Molmasse	368,47 g/mol
SMILES	C[C@@]12CCC[C@@](C)(C(=O)O)[C@H]1CC[C@@]13C[C@@H](C[C@H](O)[C@@H]21)[C@](O)(CO)[C@H]3O
InChIKey	RHWBQGFFSHIXKI-VBMXMUPNNA-N

Siedepunkt	568.3±50.0 °C(Predicted)
Dichte	1.36±0.1 g/cm3(Predicted)
pKa (Säurekonstante)	4.55±0.70(Predicted)
InChIKey	RHWBQGFFSHIXKI-VBMXMUPNNA-N
SMILES	O[C@@H]1[C@@]([C@]2([H])C[C@H](O)[C@@]3([H])[C@@]4(CCC[C@@](C)(C(=O)O)[C@@]4([H])CC[C@]13C2)C)(O)CO \|&1:1,2,3,6,8,10,14,19,23,r\|