(1S,2R,3R,4S,5R,6S,8R,9S,10S,13R,16S,17R,18S)-11-ethyl-8,9-dihydroxy-6,16,18-trimethoxy-13-methyl-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl 2-methylpropanoate

AlkaPlorer ID: AK418295

Synonym: None

IUPAC Name: (11-ethyl-8,9-dihydroxy-6,16,18-trimethoxy-13-methyl-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl) 2-methylpropanoate

Structure

SMILES: CCN1CC2(C)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC(=O)C(C)C)C(O)(C(OC)C23)C14

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InChI: InChI=1S/C28H45NO7/c1-8-29-13-25(4)10-9-18(34-6)27-16-11-15-17(33-5)12-26(31,19(16)20(15)36-23(30)14(2)3)28(32,24(27)29)22(35-7)21(25)27/h14-22,24,31-32H,8-13H2,1-7H3

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InChIKey: JAKRMJRMMPOUJX-UHFFFAOYSA-N

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Source

Properties Information

Molecule Weight: 507.6680000000003

TPSA: 97.69000000000004

MolLogP: 1.8514000000000008

Number of H-Donors: 2

Number of H-Acceptors: 8

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information