Trienomycin H

AlkaPlorer ID: AK116286

Synonym: None

IUPAC Name: [(5R,6E,8E,10E,13S,14R,15R,16Z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2S)-2-acetamidopropanoate

Structure

SMILES: CO[C@H]1/C=C/C=C/C=C/C[C@H](OC(=O)[C@H](C)N=C(C)O)[C@H](C)[C@@H](O)/C(C)=C\CCC2=CC(=CC(O)=C2)N=C(O)C1

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InChI: InChI=1S/C31H42N2O7/c1-20-12-11-13-24-16-25(18-26(35)17-24)33-29(36)19-27(39-5)14-9-7-6-8-10-15-28(21(2)30(20)37)40-31(38)22(3)32-23(4)34/h6-10,12,14,16-18,21-22,27-28,30,35,37H,11,13,15,19H2,1-5H3,(H,32,34)(H,33,36)/b7-6+,10-8+,14-9+,20-12-/t21-,22-,27-,28-,30-/m0/s1

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InChIKey: XABMJNPASAJFSG-LVMMZXKTSA-N

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Source

Properties Information

Molecule Weight: 554.6840000000002

TPSA: 141.17000000000002

MolLogP: 5.610200000000006

Number of H-Donors: 4

Number of H-Acceptors: 7

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information