Nerbowdine; Demethoxy

AlkaPlorer ID: AK307658

Synonym: Cribetamine

IUPAC Name: 5,7-dioxa-12-azapentacyclo[10.5.2.01,13.02,10.04,8]nonadeca-2,4(8),9-triene-15,17-diol

Structure

SMILES: OC1CC(O)C23CCN(CC4=CC5=C(C=C42)OCO5)C3C1

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InChI: InChI=1S/C16H19NO4/c18-10-4-14-16(15(19)5-10)1-2-17(14)7-9-3-12-13(6-11(9)16)21-8-20-12/h3,6,10,14-15,18-19H,1-2,4-5,7-8H2

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InChIKey: JXWWVQNGNUPPCT-UHFFFAOYSA-N

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Reference

PubChem CID: 625763

CAS: 97673-68-2

COCONUT: CNP0424880.1

Source

Species Genus Family Order Class Phylum Kingdom Domain
Crinum oliganthum Crinum Amaryllidaceae Asparagales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 289.331

TPSA: 62.16000000000001

MolLogP: 0.7565999999999997

Number of H-Donors: 2

Number of H-Acceptors: 5

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information