dendrobine

AlkaPlorer ID: AK318586

Synonym: None

IUPAC Name: (1S,4S,7S,8R,11R,13S)-2,12-dimethyl-13-propan-2-yl-10-oxa-2-azatetracyclo[5.4.1.18,11.04,12]tridecan-9-one

Structure

SMILES: CC(C)[C@@H]1[C@H]2OC(=O)[C@@H]1[C@@H]1CC[C@@H]3CN(C)[C@H]2C31C

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InChI: InChI=1S/C16H25NO2/c1-8(2)11-12-10-6-5-9-7-17(4)14(16(9,10)3)13(11)19-15(12)18/h8-14H,5-7H2,1-4H3/t9-,10+,11+,12-,13-,14-,16?/m1/s1

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InChIKey: RYAHJFGVOCZDEI-XAESKYSMSA-N

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Reference

PubChem CID: 11972333

NPASS: NPC143159

Properties Information

Molecule Weight: 263.381

TPSA: 29.54

MolLogP: 2.1603000000000003

Number of H-Donors: 0

Number of H-Acceptors: 3

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information