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3-amino-6-(aminomethyl)-2-[4,6-diamino-3-(3,4-diamino-5-methoxyoxan-2-yl)oxy-2-hydroxycyclohexyl]oxyoxan-4-ol

3-amino-6-(aminomethyl)-2-[4,6-diamino-3-(3,4-diamino-5-methoxyoxan-2-yl)oxy-2-hydroxycyclohexyl]oxyoxan-4-ol structure

CAS No:
56276-26-7
Formula:
C18H38N6O7
Chemical Name:
3-amino-6-(aminomethyl)-2-[4,6-diamino-3-(3,4-diamino-5-methoxyoxan-2-yl)oxy-2-hydroxycyclohexyl]oxyoxan-4-ol
Synonyms:
Seldomycin factor 5 trisulfate hexahydrate; XK-88-5 trisulfate hexahydrate;

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3-amino-6-(aminomethyl)-2-[4,6-diamino-3-(3,4-diamino-5-methoxyoxan-2-yl)oxy-2-hydroxycyclohexyl]oxyoxan-4-ol Basic Attributes

Molecular Weight：

450.53000

Exact Mass：

450.28019757

Characteristics

PSA：

242.73000

XLogP3：

-0.83440

Density：

1.39g/cm3

Boiling Point：

678.6ºC at 760 mmHg

Flash Point：

364.2ºC

Refractive Index：

1.613

Computed Properties

Molecular Weight:450.5
XLogP3:-6.4
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:6
Exact Mass:450.28019757
Monoisotopic Mass:450.28019757
Topological Polar Surface Area:243
Heavy Atom Count:31
Complexity:580
Undefined Atom Stereocenter Count:13
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-amino-6-(aminomethyl)-2-[4,6-diamino-3-(3,4-diamino-5-methoxyoxan-2-yl)oxy-2-hydroxycyclohexyl]oxyoxan-4-ol

Basic Attributes
Characteristics
Computed Properties

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