Daphnigracine; 5-Epimer, 11ξ-hydroxy, 14,15-didehydro

AlkaPlorer ID: AK294347

Synonym: Daphlongamine J

IUPAC Name: None

Structure

SMILES: COC(=O)C1=C2CCC3=C2C2(C1)CN(C)CC(CC3O)C21CCC(O)(C(C)C)OC1

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InChI: InChI=1S/C24H35NO5/c1-14(2)24(28)8-7-22(13-30-24)15-9-19(26)17-6-5-16-18(21(27)29-4)10-23(22,20(16)17)12-25(3)11-15/h14-15,19,26,28H,5-13H2,1-4H3

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InChIKey: AUBFAQGHNGZMJT-UHFFFAOYSA-N

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Reference

CAS: 1345977-40-3

Properties Information

Molecule Weight: 417.5460000000002

TPSA: 79.23

MolLogP: 2.404100000000001

Number of H-Donors: 2

Number of H-Acceptors: 6

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information