Himbacine; 9β-Hydroxy, 3a,9a-didehydro 

AlkaPlorer ID: AK300446

Synonym: Alkaloid GB19, GB19, 9-Epihimgrine

IUPAC Name: None

Structure

SMILES: CC1OC(=O)C2=C1C(C=CC1CCCC(C)N1C)C1CCCCC1C2O

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InChI: InChI=1S/C22H33NO3/c1-13-7-6-8-15(23(13)3)11-12-17-16-9-4-5-10-18(16)21(24)20-19(17)14(2)26-22(20)25/h11-18,21,24H,4-10H2,1-3H3

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InChIKey: IFEBFWDCFVNLEE-UHFFFAOYSA-N

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Reference

CAS: 1264110-31-7

Properties Information

Molecule Weight: 359.5100000000001

TPSA: 49.77

MolLogP: 3.454400000000003

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information