(1S,4S,5R,6R,8R,9R,14R,15S,18S,21R,23S,24R)-24-methoxy-4,8,12,23-tetramethylspiro[17,25-dioxa-19-azaheptacyclo[19.3.1.115,18.01,19.04,18.06,15.09,14]hexacos-11-ene-5,4'-oxolane]-2',7,10,26-tetrone

AlkaPlorer ID: AK136284

Synonym: None

IUPAC Name: (1S,4S,5R,6R,8R,9R,14R,15S,18S,21R,23S,24R)-24-methoxy-4,8,12,23-tetramethylspiro[17,25-dioxa-19-azaheptacyclo[19.3.1.115,18.01,19.04,18.06,15.09,14]hexacos-11-ene-5,4'-oxolane]-2',7,10,26-tetrone

Structure

SMILES: CO[C@@H]1[C@@H](C)C[C@@H]2CN3[C@@]1(CC[C@@]1(C)[C@]4(COC(=O)C4)[C@H]4C(=O)[C@H](C)[C@@H]5C(=O)C=C(C)C[C@H]5[C@@]45CO[C@@]31C5=O)O2

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InChI: InChI=1S/C31H39NO8/c1-15-8-19-22(20(33)9-15)17(3)23(35)24-28(11-21(34)38-13-28)27(4)6-7-30-25(37-5)16(2)10-18(40-30)12-32(30)31(27)26(36)29(19,24)14-39-31/h9,16-19,22,24-25H,6-8,10-14H2,1-5H3/t16-,17+,18+,19+,22-,24+,25+,27-,28+,29-,30-,31+/m0/s1

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InChIKey: YJZUIOINBIUJGR-XRKOFXFSSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Zoanthus kuroshio Zoanthus Zoanthidae Zoantharia Anthozoa Cnidaria Metazoa Eukaryota

Properties Information

Molecule Weight: 553.6520000000004

TPSA: 108.44

MolLogP: 2.4538

Number of H-Donors: 0

Number of H-Acceptors: 9

RingCount: 8

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
None Neutrophil Inhibition 20.0 % 10.1021/acs.jnatprod.6b00625
None Neutrophil Inhibition 33.0 % 10.1021/acs.jnatprod.6b00625

Metabolism Information