1,3,5,6,9,11,17,33,37-NONAHYDROXY-15,16,18-TRIMETHYL-13-OXO-14,39-DIOXABICYCLO[33.3.1]NONATRIACONTA-19,21,23,25,27,29,31-HEPTAENE-36-CARBOXYLIC ACID
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![1,3,5,6,9,11,17,33,37-NONAHYDROXY-15,16,18-TRIMETHYL-13-OXO-14,39-DIOXABICYCLO[33.3.1]NONATRIACONTA-19,21,23,25,27,29,31-HEPTAENE-36-CARBOXYLIC ACID structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/39a1742de6594fc28c6f9bb691eca7af.png "1,3,5,6,9,11,17,33,37-NONAHYDROXY-15,16,18-TRIMETHYL-13-OXO-14,39-DIOXABICYCLO[33.3.1]NONATRIACONTA-19,21,23,25,27,29,31-HEPTAENE-36-CARBOXYLIC ACID")
1,3,5,6,9,11,17,33,37-NONAHYDROXY-15,16,18-TRIMETHYL-13-OXO-14,39-DIOXABICYCLO[33.3.1]NONATRIACONTA-19,21,23,25,27,29,31-HEPTAENE-36-CARBOXYLIC ACID
structure -
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CAS No:
106799-07-9
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Formula:
C41H62O14
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Chemical Name:
1,3,5,6,9,11,17,33,37-NONAHYDROXY-15,16,18-TRIMETHYL-13-OXO-14,39-DIOXABICYCLO[33.3.1]NONATRIACONTA-19,21,23,25,27,29,31-HEPTAENE-36-CARBOXYLIC ACID
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Synonyms:
amphotericin B aglycone;amphoteronolide B;Amphoteronolide B;106799-07-9;Amphotericin B aglycone;DTXSID00910115;(1S,3R,18S,19R,20R,21S,25R,27R,30R,31R,33S,35R,37S,38R)-3,19,25,27,30,31,33,35,37-nonahydroxy-18,20,21-trimethyl-23-oxo-22,39-dioxabicyclo[33.3.1]nonatriaconta-4,6,8,10,12,14,16-heptaene-38-carboxylic acid;1,3,5,6,9,11,17,33,37-NONAHYDROXY-15,16,18-TRIMETHYL-13-OXO-14,39-DIOXABICYCLO[33.3.1]NONATRIACONTA-19,21,23,25,27,29,31-HEPTAENE-36-CARBOXYLIC ACID;14,39-Dioxabicyclo(33.3.1)nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxylic acid, 1,3,5,6,9,11,17,33,37-nonahydroxy-15,16,18-trimethyl-13-oxo-, (1R-(1R*,3S*,5R*,6R*,9R*,11R*,15S*,16R*,17R*,18S*,19E,21E,23E,25E,27E,29E,31E,33R*,35S*,36R*,37S*))-
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CAS No:
1,3,5,6,9,11,17,33,37-NONAHYDROXY-15,16,18-TRIMETHYL-13-OXO-14,39-DIOXABICYCLO[33.3.1]NONATRIACONTA-19,21,23,25,27,29,31-HEPTAENE-36-CARBOXYLIC ACID Basic Attributes
778.9 g/mol
778.41395665 g/mol
Computed Properties
Molecular Weight:778.9
XLogP3:3.6
Hydrogen Bond Donor Count:10
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:1
Exact Mass:778.41395665
Monoisotopic Mass:778.41395665
Topological Polar Surface Area:255
Heavy Atom Count:55
Complexity:1370
Defined Atom Stereocenter Count:14
Undefined Bond Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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