Navigation

name Structure Reference Source Properties Activities Metabolism

None

AlkaPlorer ID: AK339067

Synonym: None

IUPAC Name: [(10R)-1-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-6-methyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-8-[(2S)-2-methylbutanoyl]-3-oxo-1,4,8-triazacyclotridec-10-yl] acetate

Structure

SMILES: CC[C@H](C)C(=O)N1CCCN=C(O)CN(O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CCC[C@@H](OC(C)=O)C1

copy

InChI: InChI=1S/C29H51N3O14/c1-5-15(2)27(41)31-10-7-9-30-20(35)13-32(11-6-8-18(12-31)43-17(4)34)46-29-26(24(39)21(36)16(3)42-29)45-28-25(40)23(38)22(37)19(14-33)44-28/h15-16,18-19,21-26,28-29,33,36-40H,5-14H2,1-4H3,(H,30,35)/t15-,16-,18+,19+,21-,22+,23-,24+,25+,26+,28-,29-/m0/s1

copy

InChIKey: AYYUMTOLYXUKDH-OTKRAXTQSA-N

copy

Source

Species Genus Family Order Class Phylum Kingdom Domain
Meehania urticifolia Meehania Lamiaceae Lamiales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 665.734

TPSA？: 240.73999999999995

MolLogP？: -2.181499999999991

Number of H-Donors: 7

Number of H-Acceptors: 15

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information