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

AlkaPlorer ID: AK352730

Synonym: None

IUPAC Name: 7,17-dimethoxy-11-methyl-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1,6,8(20),14,16,18-hexaen-16-ol

Structure

SMILES: COC1=CC2=C(C=C1O)CC1C3=C(CCN1C)C(OC)=C1OCOC1=C23

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InChI: InChI=1S/C20H21NO5/c1-21-5-4-11-16-13(21)6-10-7-14(22)15(23-2)8-12(10)17(16)19-20(18(11)24-3)26-9-25-19/h7-8,13,22H,4-6,9H2,1-3H3

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InChIKey: CELDISJHFVNAQK-UHFFFAOYSA-N

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Source

Properties Information

Molecule Weight: 355.39000000000016

TPSA: 60.390000000000015

MolLogP: 2.890200000000001

Number of H-Donors: 1

Number of H-Acceptors: 6

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information