(12S)-7,15,16,17-tetramethoxy-3,5-dioxa-11-azapentacyclo[10.7.1.0²,⁶.0⁸,²⁰.0¹⁴,¹⁹]icosa-1(20),2(6),7,14(19),15,17-hexaene

AlkaPlorer ID: AK097918

Synonym: None

IUPAC Name: (12S)-7,15,16,17-tetramethoxy-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1,6,8(20),14,16,18-hexaene

Structure

SMILES: COC1=CC2=C(C[C@@H]3NCCC4=C3C2=C2OCOC2=C4OC)C(OC)=C1OC

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InChI: InChI=1S/C21H23NO6/c1-23-14-8-11-12(18(25-3)19(14)26-4)7-13-15-10(5-6-22-13)17(24-2)21-20(16(11)15)27-9-28-21/h8,13,22H,5-7,9H2,1-4H3/t13-/m0/s1

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InChIKey: CBDDDWACOGBURC-ZDUSSCGKSA-N

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Reference

PubChem CID: 162919231

SuperNatural Ⅲ: SN0040958-01

NPASS: NPC157940

Properties Information

Molecule Weight: 385.41600000000017

TPSA: 67.41000000000001

MolLogP: 2.8596000000000013

Number of H-Donors: 1

Number of H-Acceptors: 7

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information