Tirandamycin C

AlkaPlorer ID: AK022864

Synonym: None

IUPAC Name: 3-[(6R)-1-hydroxy-4-methyl-6-[(1R,3R,4S,5R)-1,4,8-trimethyl-2,9-dioxabicyclo[3.3.1]non-7-en-3-yl]hepta-2,4-dienylidene]pyrrolidine-2,4-dione

Structure

SMILES: CC(C=CC(O)=C1C(=O)CN=C1O)=C[C@@H](C)[C@H]1O[C@@]2(C)O[C@H](CC=C2C)[C@@H]1C

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InChI: InChI=1S/C22H29NO5/c1-12(6-8-16(24)19-17(25)11-23-21(19)26)10-13(2)20-15(4)18-9-7-14(3)22(5,27-18)28-20/h6-8,10,13,15,18,20,24H,9,11H2,1-5H3,(H,23,26)/t13-,15+,18-,20-,22-/m1/s1

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InChIKey: WWRZQUIPJGHZFD-AHGQDJORSA-N

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Source

Properties Information

Molecule Weight: 387.47600000000017

TPSA: 88.35000000000001

MolLogP: 3.962600000000004

Number of H-Donors: 2

Number of H-Acceptors: 5

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information