narasin

(2R)-2-[(2R,3S,5S,6R)-6-[(2S,3S,4S,6R)-6-[(3S,5S,7R,9S,10S,12R,15R)-3-[(2R,5R,6S)-5-ethyl-5-hydroxy-6-methyloxan-2-yl]-15-hydroxy-3,10,12-trimethyl-4,6,8-trioxadispiro[4.1.57.35]pentadec-13-en-9-yl]-3-hydroxy-4-methyl-5-oxooctan-2-yl]-3,5-dimethyloxan-2-yl]butanoic acid

CAS: 55134-13-9

Molecular Formula	`C43H72O11`
Molecular Weight	765.0 g/mol
LogP	6.2
Topological Polar Surface Area	161.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	11
Rotatable Bonds	12
Exact Mass	764.50745
Heavy Atoms	54
Complexity	1360.0

Chemical Identifiers

CAS Number	55134-13-9
SMILES	`CCC(C1C(CC(C(O1)C(C)C(C(C)C(=O)C(CC)C2C(CC(C3(O2)C=CC(C4(O3)CCC(O4)(C)C5CCC(C(O5)C)(CC)O)O)C)C)O)C)C)C(=O)O`
InChIKey	`VHKXXVVRRDYCIK-CWCPJSEDSA-N`

📖 Product Overview

narasin (CAS: 55134-13-9) is a chemical compound with molecular formula C43H72O11 and molecular weight 765.0 g/mol. Its IUPAC systematic name is (2R)-2-[(2R,3S,5S,6R)-6-[(2S,3S,4S,6R)-6-[(3S,5S,7R,9S,10S,12R,15R)-3-[(2R,5R,6S)-5-ethyl-5-hydroxy-6-methyloxan-2-yl]-15-hydroxy-3,10,12-trimethyl-4,6,8-trioxadispiro[4.1.57.35]pentadec-13-en-9-yl]-3-hydroxy-4-methyl-5-oxooctan-2-yl]-3,5-dimethyloxan-2-yl]butanoic acid. LogP 6.2 Topological Polar Surface Area 161.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 11 Rotatable Bonds 12 Exact Mass 764.50745 Heavy Atoms 54 Complexity 1360.0 InChI Key: VHKXXVVRRDYCIK-CWCPJSEDSA-N. SMILES: CCC(C1C(CC(C(O1)C(C)C(C(C)C(=O)C(CC)C2C(CC(C3(O2)C=CC(C4(O3)CCC(O4)(C)C5CCC(C(O5)C)(CC)O)O)C)C)O)C)C)C(=O)O.

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