UNPD27235

AlkaPlorer ID: AK403929

Synonym: None

IUPAC Name: 4-hydroxyimino-3-methoxy-17-(methoxymethyl)-2-methyl-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-16-one

Structure

SMILES: COCN1CC2=C(C1=O)C1=C3C4=C2C2=CC=CC=C2N4C2(C)OC(CC(=NO)C2OC)N3C2=CC=CC=C12

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InChI: InChI=1S/C29H26N4O5/c1-29-27(37-3)18(30-35)12-21(38-29)32-19-10-6-4-8-15(19)23-24-17(13-31(14-36-2)28(24)34)22-16-9-5-7-11-20(16)33(29)26(22)25(23)32/h4-11,21,27,35H,12-14H2,1-3H3

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InChIKey: HSTNZDLROFJOCU-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 510.5500000000002

TPSA: 90.45000000000002

MolLogP: 4.912500000000004

Number of H-Donors: 1

Number of H-Acceptors: 8

RingCount: 8

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information