Spirotoamide C

AlkaPlorer ID: AK046895

Synonym: 'Spirotoamide D'

IUPAC Name: (2E,4E)-10-[(2S,4S,5S,6S,8R,9S,10R)-4,10-dihydroxy-5,8,9-trimethyl-1,7-dioxaspiro[5.5]undecan-2-yl]-4-ethyl-8-(hydroxymethyl)undeca-2,4-dienamide

Structure

SMILES: CCC(/C=C/C(=N)O)=C\CCC(CO)CC(C)[C@@H]1C[C@H](O)[C@H](C)[C@]2(C[C@@H](O)[C@H](C)[C@@H](C)O2)O1

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InChI: InChI=1S/C26H45NO6/c1-6-20(10-11-25(27)31)8-7-9-21(15-28)12-16(2)24-13-22(29)18(4)26(33-24)14-23(30)17(3)19(5)32-26/h8,10-11,16-19,21-24,28-30H,6-7,9,12-15H2,1-5H3,(H2,27,31)/b11-10+,20-8+/t16?,17-,18+,19-,21?,22+,23-,24+,26+/m1/s1

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InChIKey: CXKYSHXDAZLAHV-KFOFLDPYSA-N

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Properties Information

Molecule Weight: 467.6470000000002

TPSA: 123.23000000000002

MolLogP: 4.117170000000003

Number of H-Donors: 5

Number of H-Acceptors: 6

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information