Ulithiacyclamide F

AlkaPlorer ID: AK034836

Synonym: ''

IUPAC Name: (1R,4R,5S,8R,15R,18S,21R)-8-benzyl-21-[(2R)-butan-2-yl]-18-[(1R)-1-hydroxyethyl]-4-methyl-3-oxa-10,23,29,30-tetrathia-7,14,17,20,27,32,33,34-octazapentacyclo[13.12.4.12,5.19,12.122,25]tetratriaconta-2(34),9(33),11,22(32),24-pentaene-6,13,16,19,26-pentone

Structure

SMILES: CC[C@@H](C)[C@H]1N=C(O)[C@H]([C@@H](C)O)N=C(O)[C@@H]2CSSC[C@H](N=C(O)C3=CSC1=N3)C1=N[C@H](C(O)=N[C@H](CC3=CC=CC=C3)C3=NC(=CS3)C(O)=N2)[C@@H](C)O1

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InChI: InChI=1S/C35H42N8O7S4/c1-5-16(2)25-35-40-22(13-52-35)29(46)38-24-15-54-53-14-23(30(47)42-26(17(3)44)31(48)41-25)37-28(45)21-12-51-34(39-21)20(11-19-9-7-6-8-10-19)36-32(49)27-18(4)50-33(24)43-27/h6-10,12-13,16-18,20,23-27,44H,5,11,14-15H2,1-4H3,(H,36,49)(H,37,45)(H,38,46)(H,41,48)(H,42,47)/t16-,17-,18-,20-,23+,24+,25-,26+,27+/m1/s1

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InChIKey: YASDULZMSFBKMX-NLUXLWHWSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Lissoclinum patella Lissoclinum Didemnidae Aplousobranchia Ascidiacea Chordata Metazoa Eukaryota

Properties Information

Molecule Weight: 815.038

TPSA: 230.54999999999995

MolLogP: 6.2305000000000055

Number of H-Donors: 6

Number of H-Acceptors: 14

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information