 Home > Encyclopedia > 6-Amino-9-methyl-7-[(2E)-3-methyl-5-[(1R)-1,2,3,4,4aβ,5,6,7-octahydro-1,2β,5,5-tetramethylnaphthalen-1α-yl]-2-pentenyl]-7H-purin-9-ium

6-Amino-9-methyl-7-[(2E)-3-methyl-5-[(1R)-1,2,3,4,4aβ,5,6,7-octahydro-1,2β,5,5-tetramethylnaphthalen-1α-yl]-2-pentenyl]-7H-purin-9-ium

6-Amino-9-methyl-7-[(2E)-3-methyl-5-[(1R)-1,2,3,4,4aβ,5,6,7-octahydro-1,2β,5,5-tetramethylnaphthalen-1α-yl]-2-pentenyl]-7H-purin-9-ium structure

CAS No:
92664-78-3
Formula:
C26H40N5+
Chemical Name:
6-Amino-9-methyl-7-[(2E)-3-methyl-5-[(1R)-1,2,3,4,4aβ,5,6,7-octahydro-1,2β,5,5-tetramethylnaphthalen-1α-yl]-2-pentenyl]-7H-purin-9-ium
Synonyms:
Agelasine C;6-Amino-7-[3-methyl-5-[(1,2,3,4,4abeta,5,6,7-octahydro-1,2beta,5,5-tetramethylnaphthalen)-1alpha-yl]-2-pentenyl]-9-methyl-7H-purin-9-ium

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6-Amino-9-methyl-7-[(2E)-3-methyl-5-[(1R)-1,2,3,4,4aβ,5,6,7-octahydro-1,2β,5,5-tetramethylnaphthalen-1α-yl]-2-pentenyl]-7H-purin-9-ium Basic Attributes

Molecular Weight：

422.6293

Exact Mass：

422.328

Characteristics

PSA：

60.6

XLogP3：

6.4

Computed Properties

Molecular Weight:422.6
XLogP3:6.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:422.32837130
Monoisotopic Mass:422.32837130
Topological Polar Surface Area:60.6
Heavy Atom Count:31
Formal Charge:1
Complexity:713
Defined Atom Stereocenter Count:3
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: vanillin structure; capric triglyceride; toluene msds; petroleum ether structure; cineole; 2 methyl 2 butene

Guide of 6-Amino-9-methyl-7-[(2E)-3-methyl-5-[(1R)-1,2,3,4,4aβ,5,6,7-octahydro-1,2β,5,5-tetramethylnaphthalen-1α-yl]-2-pentenyl]-7H-purin-9-ium

Basic Attributes
Characteristics
Computed Properties

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