(1R,24R)-24-hydroxy-13-methyl-5,7,17,19-tetraoxa-13-azahexacyclo[11.11.0.0²,¹⁰.0⁴,⁸.0¹⁵,²³.0¹⁶,²⁰]tetracosa-2(10),3,8,15(23),16(20),21-hexaen-13-ium

AlkaPlorer ID: AK277601

Synonym: None

IUPAC Name: (1R,13S,24R)-13-methyl-5,7,17,19-tetraoxa-13-azoniahexacyclo[11.11.0.02,10.04,8.015,23.016,20]tetracosa-2,4(8),9,15(23),16(20),21-hexaen-24-ol

Structure

SMILES: C[N@@+]12CCC3=CC4=C(C=C3[C@@H]1[C@H](O)C1=CC=C3OCOC3=C1C2)OCO4

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InChI: InChI=1S/C20H20NO5/c1-21-5-4-11-6-16-17(25-9-24-16)7-13(11)18(21)19(22)12-2-3-15-20(14(12)8-21)26-10-23-15/h2-3,6-7,18-19,22H,4-5,8-10H2,1H3/q+1/t18-,19-,21+/m1/s1

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InChIKey: UUWJGESPDDCCLS-SBHAEUEKSA-N

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Reference

PubChem CID: 162802574

SuperNatural Ⅲ: SN0380769-01

NPASS: NPC206304

Properties Information

Molecule Weight: 354.3820000000002

TPSA: 57.150000000000006

MolLogP: 2.435

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information