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name Structure Reference Source Properties Activities Metabolism

(1R,4S,5R,6R,7R,17R)-4,7-dihydroxy-4-(hydroxymethyl)-5,6,7-trimethyl-2,9-dioxa-14-azatricyclo[9.5.1.0¹⁴,¹⁷]heptadec-11-ene-3,8-dione

AlkaPlorer ID: AK022226

Synonym: None

IUPAC Name: (1R,4S,5R,6R,7R,17R)-4,7-dihydroxy-4-(hydroxymethyl)-5,6,7-trimethyl-2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadec-11-ene-3,8-dione

Structure

SMILES: C[C@@H]1[C@@H](C)[C@](O)(CO)C(=O)O[C@@H]2CCN3CC=C(COC(=O)[C@]1(C)O)[C@H]23

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InChI: InChI=1S/C18H27NO7/c1-10-11(2)18(24,9-20)16(22)26-13-5-7-19-6-4-12(14(13)19)8-25-15(21)17(10,3)23/h4,10-11,13-14,20,23-24H,5-9H2,1-3H3/t10-,11-,13-,14-,17-,18-/m1/s1

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InChIKey: KWEQCWXCFQWUQU-FQPKLTCISA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Senecio latifolius Senecio Asteraceae Asterales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 369.4140000000001

TPSA？: 116.53000000000002

MolLogP？: -0.7840999999999985

Number of H-Donors: 3

Number of H-Acceptors: 8

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information