Molecule

Turbostatin 1

AlkaPlorer ID: AK048727

Synonym: '(-)-Turbostatin 3', 'Turbostatin 3', '(+)-Turbostatin 1'

IUPAC Name: N-[(Z,2S,3R)-3-hydroxy-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexadec-4-en-2-yl]hexadecanamide

Structure

SMILES: CCCCCCCCCCC/C=C\[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)N=C(O)CCCCCCCCCCCCCCC

InChI: InChI=1S/C38H73NO8/c1-3-5-7-9-11-13-15-16-18-20-22-24-26-28-34(42)39-31(30-46-38-37(45)36(44)35(43)33(29-40)47-38)32(41)27-25-23-21-19-17-14-12-10-8-6-4-2/h25,27,31-33,35-38,40-41,43-45H,3-24,26,28-30H2,1-2H3,(H,39,42)/b27-25-/t31-,32+,33+,35-,36-,37+,38+/m0/s1

InChIKey: MRQVBTPSVJFXHV-KQCPKBSLSA-N

Reference

Antineoplastic Agents. 545. Isolation and Structure of Turbostatins 1−4 from the Asian Marine Mollusk<i>Turbo stenogyrus</i><sup>,1</sup>

PubChem CID: 162947292

LOTUS: LTS0092050

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Turbo stenogyrus	Turbo	Turbinidae	Trochida	Gastropoda	Mollusca	Metazoa	Eukaryota

Properties Information

Molecule Weight: 672.0009999999995

TPSA？: 152.20000000000002

MolLogP？: 7.447300000000007

Number of H-Donors: 6

Number of H-Acceptors: 8

RingCount: 1

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi