 Home > Encyclopedia > (2S,5R,5aS,5bS,7aS,7bR,10aS,11aS,11bS,13aR)-Octadecahydro-5a,7a-dimethyl-2,5-epoxyfuro[3′′,2′′:3′,4′]cyclopenta[1′,2′:5,6]naphth[1,2-d]azepin-9(1H)-one

(2S,5R,5aS,5bS,7aS,7bR,10aS,11aS,11bS,13aR)-Octadecahydro-5a,7a-dimethyl-2,5-epoxyfuro[3′′,2′′:3′,4′]cyclopenta[1′,2′:5,6]naphth[1,2-d]azepin-9(1H)-one

(2S,5R,5aS,5bS,7aS,7bR,10aS,11aS,11bS,13aR)-Octadecahydro-5a,7a-dimethyl-2,5-epoxyfuro[3′′,2′′:3′,4′]cyclopenta[1′,2′:5,6]naphth[1,2-d]azepin-9(1H)-one structure

CAS No:
6384-73-2
Formula:
C21H31NO3
Chemical Name:
(2S,5R,5aS,5bS,7aS,7bR,10aS,11aS,11bS,13aR)-Octadecahydro-5a,7a-dimethyl-2,5-epoxyfuro[3′′,2′′:3′,4′]cyclopenta[1′,2′:5,6]naphth[1,2-d]azepin-9(1H)-one
Synonyms:
2,5-Epoxyfuro[3′′,2′′:3′,4′]cyclopenta[1′,2′:5,6]naphth[1,2-d]azepin-9(1H)-one,octadecahydro-5a,7a-dimethyl-,(2S,5R,5aS,5bS,7aS,7bR,10aS,11aS,11bS,13aR)-;Samandaridine;3-Aza-A-homopregnan-21-oic acid,1,4-epoxy-16-hydroxy-,γ-lactone,(1α,4α,5β,16β)-;(2S,5R,5aS,5bS,7aS,7bR,10aS,11aS,11bS,13aR)-Octadecahydro-5a,7a-dimethyl-2,5-epoxyfuro[3′′,2′′:3′,4′]cyclopenta[1′,2′:5,6]naphth[1,2-d]azepin-9(1H)-one;Samandaridin;2,5-Epoxyfuro[3′′,2′′:3′,4′]cyclopenta[1′,2′:5,6]naphth[1,2-d]azepin-9(1H)-one,octadecahydro-5a,7a-dimethyl-,[2S-(2α,5α,5aβ,5bα,7aβ,7bα,10aα,11aα,11bβ,13aβ)]-;31561-29-2;1071658-61-1

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(2S,5R,5aS,5bS,7aS,7bR,10aS,11aS,11bS,13aR)-Octadecahydro-5a,7a-dimethyl-2,5-epoxyfuro[3′′,2′′:3′,4′]cyclopenta[1′,2′:5,6]naphth[1,2-d]azepin-9(1H)-one Basic Attributes

Molecular Weight：

345.48

Exact Mass：

345.48

Characteristics

PSA：

47.6

XLogP3：

3.9

Melting Point：

287-288 °C

Computed Properties

Molecular Weight:345.5
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Exact Mass:345.23039385
Monoisotopic Mass:345.23039385
Topological Polar Surface Area:47.6
Heavy Atom Count:25
Complexity:622
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (2S,5R,5aS,5bS,7aS,7bR,10aS,11aS,11bS,13aR)-Octadecahydro-5a,7a-dimethyl-2,5-epoxyfuro[3′′,2′′:3′,4′]cyclopenta[1′,2′:5,6]naphth[1,2-d]azepin-9(1H)-one

Basic Attributes
Characteristics
Computed Properties

(2S,5R,5aS,5bS,7aS,7bR,10aS,11aS,11bS,13aR)-Octadecahydro-5a,7a-dimethyl-2,5-epoxyfuro[3′′,2′′:3′,4′]cyclopenta[1′,2′:5,6]naphth[1,2-d]azepin-9(1H)-one

SDS

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