Molecule

Chaetoglobosin O

AlkaPlorer ID: AK450908

Synonym: None

IUPAC Name: (1R,6S,7E,9S,11E,13R,14S,17R,18S)-6,14-dihydroxy-18-(1H-indol-3-ylmethyl)-7,9,15,16-tetramethyl-19-azatricyclo[11.7.0.01,17]icosa-7,11,15-triene-2,5,20-trione

Structure

SMILES: CC1=C(C)[C@H]2[C@H](CC3=CNC4=CC=CC=C34)N=C(O)[C@]23C(=O)CCC(=O)[C@@H](O)/C(C)=C/[C@@H](C)C/C=C/[C@H]3[C@@H]1O

InChI: InChI=1S/C32H38N2O5/c1-17-8-7-10-23-30(38)20(4)19(3)28-25(15-21-16-33-24-11-6-5-9-22(21)24)34-31(39)32(23,28)27(36)13-12-26(35)29(37)18(2)14-17/h5-7,9-11,14,16-17,23,25,28-30,33,37-38H,8,12-13,15H2,1-4H3,(H,34,39)/b10-7+,18-14+/t17-,23-,25-,28-,29-,30+,32+/m0/s1

InChIKey: LXPGDDICGFGPQK-BOFQXVKOSA-N

Reference

Absolute stereostructures of novel cytotoxic metabolites, penostatins A–E, from a Penicillium species separated from an Enteromorpha alga

PubChem CID: 10414658

LOTUS: LTS0146296

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Ulva intestinalis	Ulva	Ulvaceae	Ulvales	Ulvophyceae	Chlorophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 530.6650000000004

TPSA？: 122.98

MolLogP？: 4.800400000000004

Number of H-Donors: 4

Number of H-Acceptors: 5

RingCount: 5

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi