Septacidin

N-[2-[[(2R,3R,4R,5S,6S)-2-[(1S)-1,2-dihydroxyethyl]-4,5-dihydroxy-6-(7H-purin-6-ylamino)oxan-3-yl]amino]-2-oxoethyl]-14-methylpentadecanamide

Also Known As: Septacidin|Spicamycin|2'-epi-septacidin|LIA-0101 B|LIA-0101|L-glycero-beta-L-gluco-Heptopyranosylamine, 4-deoxy-4-((((14-methyl-1-oxopentadecyl)amino)acetyl)amino)-N-1H-purin-6-yl-|N-[2-[[(2R,3R,4R,5S,6S)-2-[(1S)-1,2-dihydroxyethyl]-4,5-dihydroxy-6-(7H-purin-6-ylamino)oxan-3-yl]amino]-2-oxoethyl]-14-methylpentadecanamide|4-deoxy-4-{[n-(14-methylpentadecanoyl)glycyl]amino}-n-7h-purin-6-yl-l-glycero-|A-l-gluco-heptopyranosylamine|N-(1H-Purin-6-yl)-4-[[[(14-methyl-1-oxopentadecyl)amino]acetyl]amino]-4-deoxy-beta-L-glycero-L-gluco-heptopyranosylamine|N-(2-(((2R,3R,4R,5S,6S)-2-((1S)-1,2-dihydroxyethyl)-4,5-dihydroxy-6-(7H-purin-6-ylamino)oxan-3-yl)amino)-2-oxoethyl)-14-methylpentadecanamide|N-(2-(((2R,3R,4R,5S,6S)-6-((9H-purin-6-yl)amino)-2-((S)-1,2-dihydroxyethyl)-4,5-dihydroxytetrahydro-2H-pyran-3-yl)amino)-2-oxoethyl)-14-methylpentadecanamide

Molecular Formula	C30H51N7O7
Molecular Weight	621.385 g/mol
LogP	1.5
Topological Polar Surface Area	214.84 Ų
Hydrogen Bond Donors	8
Hydrogen Bond Acceptors	11
Rotatable Bonds	20
Exact Mass	621.385
Heavy Atoms	44
Complexity	1134.1

Chemical Identifiers

CAS Number	62362-59-8
SMILES	CC(C)CCCCCCCCCCCCC(=O)NCC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1[C@H](CO)O)NC2=NC=NC3=C2NC=N3)O)O