Delphatine
AlkaPlorer ID: AK055401
Synonym: ''
IUPAC Name: (1S,2R,3R,4S,5R,6S,8R,9S,10S,13S,16R,17R,18S)-11-ethyl-4,6,16,18-tetramethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9-diol
Structure
SMILES: CCN1C[C@]2(COC)CC[C@@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14
InChI: InChI=1S/C26H43NO7/c1-7-27-12-23(13-30-2)9-8-17(32-4)25-15-10-14-16(31-3)11-24(28,18(15)19(14)33-5)26(29,22(25)27)21(34-6)20(23)25/h14-22,28-29H,7-13H2,1-6H3/t14-,15-,16+,17-,18-,19+,20-,21+,22+,23+,24-,25+,26-/m1/s1
InChIKey: FYNCELMSVIDJLX-NJCARJOISA-N
Reference
14-Acetylnudicaulidine and 18-deoxylycoctonine ? New diterpene alkaloids from Delphinium confusum
PubChem CID: 162942619
LOTUS: LTS0151164
SuperNatural Ⅲ: SN0098934-05
NPASS: NPC145192
Source
Properties Information
Molecule Weight: 481.6300000000002
TPSA？: 89.85000000000001
MolLogP？: 0.925100000000003
Number of H-Donors: 2
Number of H-Acceptors: 8
RingCount: 6
Activities Information
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