Comosivine

AlkaPlorer ID: AK115098

Synonym: 'O-Methylathrocupressine'

IUPAC Name: (1S,17R)-4,5,6,17-tetramethoxy-11-azatetracyclo[9.7.0.01,14.02,7]octadeca-2,4,6,14-tetraene

Structure

SMILES: COC1=C(OC)C(OC)=C2CCCN3CCC4=CC[C@@H](OC)C[C@@]43C2=C1

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InChI: InChI=1S/C21H29NO4/c1-23-15-8-7-14-9-11-22-10-5-6-16-17(21(14,22)13-15)12-18(24-2)20(26-4)19(16)25-3/h7,12,15H,5-6,8-11,13H2,1-4H3/t15-,21+/m1/s1

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InChIKey: RDCFGNICVFXARK-VFNWGFHPSA-N

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Reference

PubChem CID: 162949164

SuperNatural Ⅲ: SN0322105-02

NPASS: NPC39380

Source

Properties Information

Molecule Weight: 359.46600000000007

TPSA: 40.16

MolLogP: 3.294800000000002

Number of H-Donors: 0

Number of H-Acceptors: 5

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information