DTXSID90859206

6-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-4-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione

CAS: 959119-26-7

Molecular Formula	`C37H67NO13`
Molecular Weight	733.9 g/mol
LogP	2.7
Topological Polar Surface Area	194.0 A2
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	14
Rotatable Bonds	7
Exact Mass	733.46124
Heavy Atoms	51
Complexity	1180.0

Chemical Identifiers

CAS Number	959119-26-7
SMILES	`CCC1C(C(C(C(=O)C(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)OC)C)OC3C(C(CC(O3)C)N(C)C)O)(C)O)C)C)O)(C)O`
InChIKey	`ULGZDMOVFRHVEP-UHFFFAOYSA-N`

📖 Product Overview

DTXSID90859206 (CAS: 959119-26-7) is a chemical compound with molecular formula C37H67NO13 and molecular weight 733.9 g/mol. Its IUPAC systematic name is 6-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-4-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione. LogP 2.7 Topological Polar Surface Area 194.0 A2 Hydrogen Bond Donors 5 Hydrogen Bond Acceptors 14 Rotatable Bonds 7 Exact Mass 733.46124 Heavy Atoms 51 Complexity 1180.0 InChI Key: ULGZDMOVFRHVEP-UHFFFAOYSA-N. SMILES: CCC1C(C(C(C(=O)C(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)OC)C)OC3C(C(CC(O3)C)N(C)C)O)(C)O)C)C)O)(C)O.

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