 Home > Encyclopedia > 9H-Phenanthro[1,2-b:9,8-b'c′]difuran-9-one, 3-(dimethylamino)-2,3,3a,4,5,5a,5b,6,7,8,8a,10a,10b,11b-tetradecahydro-8-hydroxy-3a,5b,8a-trimethyl-, (5bR,8S,8aR,10aR,10bR)-

9H-Phenanthro[1,2-b:9,8-b'c′]difuran-9-one, 3-(dimethylamino)-2,3,3a,4,5,5a,5b,6,7,8,8a,10a,10b,11b-tetradecahydro-8-hydroxy-3a,5b,8a-trimethyl-, (5bR,8S,8aR,10aR,10bR)-

9H-Phenanthro[1,2-b:9,8-b'c′]difuran-9-one, 3-(dimethylamino)-2,3,3a,4,5,5a,5b,6,7,8,8a,10a,10b,11b-tetradecahydro-8-hydroxy-3a,5b,8a-trimethyl-, (5bR,8S,8aR,10aR,10bR)- structure

CAS No:
74991-71-2
Formula:
C22H33NO4
Chemical Name:
9H-Phenanthro[1,2-b:9,8-b'c′]difuran-9-one, 3-(dimethylamino)-2,3,3a,4,5,5a,5b,6,7,8,8a,10a,10b,11b-tetradecahydro-8-hydroxy-3a,5b,8a-trimethyl-, (5bR,8S,8aR,10aR,10bR)-
Synonyms:
9H-Phenanthro[1,2-b:9,8-b'c′]difuran-9-one,3-(dimethylamino)-2,3,3a,4,5,5a,5b,6,7,8,8a,10a,10b,11b-tetradecahydro-8-hydroxy-3a,5b,8a-trimethyl-,(5bR,8S,8aR,10aR,10bR)-;15-Oxaandrost-7-ene-4-carboxylic acid,17-(dimethylamino)-3,6-dihydroxy-4-methyl-,γ-lactone,(3β,4β,5α,6β,9ξ,13ξ,14ξ)-;Icaceine

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Description

Icaceine is a diterpene alkaloid that is 6,18:14,16-diepoxypimar-7-en-18-one substituted by a hydroxy group at position 3 and a dimethyl amino group at position 15. It is isolated from Icacina guessfeldtii. It has a role as a metabolite. It is a diterpene lactone, a pimarane diterpenoid, a tertiary amino compound and a diterpene alkaloid.

9H-Phenanthro[1,2-b:9,8-b'c′]difuran-9-one, 3-(dimethylamino)-2,3,3a,4,5,5a,5b,6,7,8,8a,10a,10b,11b-tetradecahydro-8-hydroxy-3a,5b,8a-trimethyl-, (5bR,8S,8aR,10aR,10bR)- Basic Attributes

Molecular Weight：

375.5 g/mol

Exact Mass：

375.50

DSSTox ID：

DTXSID90331618

Characteristics

PSA：

59 Å²

Computed Properties

Molecular Weight:375.5
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:375.24095853
Monoisotopic Mass:375.24095853
Topological Polar Surface Area:59
Heavy Atom Count:27
Complexity:719
Defined Atom Stereocenter Count:5
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 9H-Phenanthro[1,2-b:9,8-b'c′]difuran-9-one, 3-(dimethylamino)-2,3,3a,4,5,5a,5b,6,7,8,8a,10a,10b,11b-tetradecahydro-8-hydroxy-3a,5b,8a-trimethyl-, (5bR,8S,8aR,10aR,10bR)-

Description
Basic Attributes
Characteristics
Computed Properties

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