1-(2-Aminoethyl)-3,4,5,6-tetrahydroxy-9H-fluoren-9-one; 3,6-Di-Me ether, N,N-di-Me, N-(hydroxymethyl) 

AlkaPlorer ID: AK285475

Synonym: Caulophylline D

IUPAC Name: None

Structure

SMILES: COC1=C(O)C2=C(C=C1)C(=O)C1=C2C(O)=C(OC)C=C1CC[N+](C)(C)CO

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InChI: InChI=1S/C20H23NO6/c1-21(2,10-22)8-7-11-9-14(27-4)20(25)17-15(11)18(23)12-5-6-13(26-3)19(24)16(12)17/h5-6,9,22H,7-8,10H2,1-4H3,(H-,23,24,25)/p+1

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InChIKey: ZAGLUBLOPGIVEQ-UHFFFAOYSA-O

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Reference

CAS: 1359978-58-7

Source

Properties Information

Molecule Weight: 374.4130000000001

TPSA: 96.22

MolLogP: 1.8951

Number of H-Donors: 3

Number of H-Acceptors: 6

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information