Antibiotic SF 1902A4b

2-[[(2S,3S)-3-hydroxy-2-[[(2S)-3-hydroxy-2-[[(2S)-2-[[(2S)-2-[(3-hydroxy-2-methylundecanoyl)-methylamino]-4-methylpent-4-enyl]amino]-3-methylbut-3-enoyl]amino]propanoyl]amino]butanoyl]amino]acetic acid

Also Known As: Antibiotic SF 1902A4b|SF-1902A4b|2-[[(2S,3S)-3-hydroxy-2-[[(2S)-3-hydroxy-2-[[(2S)-2-[[(2S)-2-[(3-hydroxy-2-methylundecanoyl)-methylamino]-4-methylpent-4-enyl]amino]-3-methylbut-3-enoyl]amino]propanoyl]amino]butanoyl]amino]acetic acid|Glycine, N-(N-(N-(N-(N-(3-hydroxy-2-methyl-1-oxoundecyl)-N-methyl-L-leucyl)-L-valyl)-L-seryl)-L-allothreonyl)-, rho-lactone|N-[(2S,5S,8S,11S)-1,4,7,15-Tetrahydroxy-2-[(1S)-1-hydroxyethyl]-5-(hydroxymethyl)-12,14-dimethyl-11-(2-methylprop-2-en-1-yl)-13-oxo-8-(prop-1-en-2-yl)-3,6,9,12-tetraazatricosa-3,6-dien-1-ylidene]glycine|N-[1,4,7,15-Tetrahydroxy-2-(1-hydroxyethyl)-5-(hydroxymethyl)-12,14-dimethyl-11-(2-methylprop-2-en-1-yl)-13-oxo-8-(prop-1-en-2-yl)-3,6,9,12-tetraazatricosa-3,6-dien-1-ylidene]glycine

Molecular Formula	C33H59N5O9
Molecular Weight	669.4313 g/mol
LogP	0.605
Topological Polar Surface Area	217.63 Ų
Hydrogen Bond Donors	8
Hydrogen Bond Acceptors	9
Rotatable Bonds	25
Exact Mass	669.4313
Monoisotopic Mass	669.4313
Heavy Atoms	47
Complexity	1051.5175

Chemical Identifiers

CAS Number	80458-08-8
SMILES	CCCCCCCCC(C(C)C(=O)N(C)[C@@H](CC(=C)C)CN[C@@H](C(=C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H]([C@H](C)O)C(=O)NCC(=O)O)O