 Home > Encyclopedia > (2S,3R,7R,8R,14S,17S)-15-methyl-1,15-diazapentacyclo[12.3.1.13,17.18,12.02,7]icos-12(20)-ene-6,9-dione

(2S,3R,7R,8R,14S,17S)-15-methyl-1,15-diazapentacyclo[12.3.1.13,17.18,12.02,7]icos-12(20)-ene-6,9-dione

(2S,3R,7R,8R,14S,17S)-15-methyl-1,15-diazapentacyclo[12.3.1.13,17.18,12.02,7]icos-12(20)-ene-6,9-dione structure

CAS No:
71812-08-3
Formula:
C19H26N2O2
Chemical Name:
(2S,3R,7R,8R,14S,17S)-15-methyl-1,15-diazapentacyclo[12.3.1.13,17.18,12.02,7]icos-12(20)-ene-6,9-dione
Synonyms:
herqueline;herquline;herquline A;Herquline;Herqueline;71812-08-3;Herquiline;Herquline A;DTXSID90222097;4H-5,2-(Iminomethano)-11,7-methenopyrrolo(3,2,1-no)(1)benzazacycloundecine-10,12-dione, 1,2,5,6,8,9,11,11a,13,14,14a,14b-dodecahydro-16-methyl-, (2R*,5R*,11S*,11aS*,14aS*,14bR*)-(-)-;(2R,5R,11S,11aS,14aS,14bR)-rel-(-)-1,2,5,6,8,9,11,11a,13,14,14a,14b-dodecahydro-16-methyl-4H-5,2-(iminomethano)-11,7-methenopyrrolo[3,2,1-no][1]benzazacycloundecine-10,12-dione

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(2S,3R,7R,8R,14S,17S)-15-methyl-1,15-diazapentacyclo[12.3.1.13,17.18,12.02,7]icos-12(20)-ene-6,9-dione Basic Attributes

Molecular Weight：

314.4 g/mol

Exact Mass：

314.199428076 g/mol

DSSTox ID：

DTXSID90222097

Characteristics

PSA：

40.6 Å²

Drug Information

MeSH Entry Terms：

herqueline

Computed Properties

Molecular Weight:314.4
XLogP3:0.7
Hydrogen Bond Acceptor Count:4
Exact Mass:314.199428076
Monoisotopic Mass:314.199428076
Topological Polar Surface Area:40.6
Heavy Atom Count:23
Complexity:598
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (2S,3R,7R,8R,14S,17S)-15-methyl-1,15-diazapentacyclo[12.3.1.13,17.18,12.02,7]icos-12(20)-ene-6,9-dione

Basic Attributes
Characteristics
Drug Information
Computed Properties

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