(4aS)-5-[(R)-2-[(S)-2-[(S)-1,2-Dihydroxyethyl]oxiranyl]-2-hydroxyethyl]-3,4,4aα,5,6,7,8,8a-octahydro-5β,6α,8aβ-trimethyl-1-naphthalenecarbaldehyde
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![(4aS)-5-[(R)-2-[(S)-2-[(S)-1,2-Dihydroxyethyl]oxiranyl]-2-hydroxyethyl]-3,4,4aα,5,6,7,8,8a-octahydro-5β,6α,8aβ-trimethyl-1-naphthalenecarbaldehyde structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/166beea8244741cfadadad75d4f8a7d9.png "(4aS)-5-[(R)-2-[(S)-2-[(S)-1,2-Dihydroxyethyl]oxiranyl]-2-hydroxyethyl]-3,4,4aα,5,6,7,8,8a-octahydro-5β,6α,8aβ-trimethyl-1-naphthalenecarbaldehyde")
(4aS)-5-[(R)-2-[(S)-2-[(S)-1,2-Dihydroxyethyl]oxiranyl]-2-hydroxyethyl]-3,4,4aα,5,6,7,8,8a-octahydro-5β,6α,8aβ-trimethyl-1-naphthalenecarbaldehyde
structure -
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CAS No:
90578-10-2
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Formula:
C20H32O5
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Chemical Name:
(4aS)-5-[(R)-2-[(S)-2-[(S)-1,2-Dihydroxyethyl]oxiranyl]-2-hydroxyethyl]-3,4,4aα,5,6,7,8,8a-octahydro-5β,6α,8aβ-trimethyl-1-naphthalenecarbaldehyde
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Synonyms:
PR-1421;Tetrahydroclerocidin;(4aS)-5-[(R)-2-[(S)-2-[(S)-1,2-Dihydroxyethyl]oxiranyl]-2-hydroxyethyl]-3,4,4aα,5,6,7,8,8a-octahydro-5β,6α,8aβ-trimethyl-1-naphthalenecarbaldehyde;(4aS)-5α-[(2R)-2-[(2S)-2-[(1S)-1,2-Dihydroxyethyl]oxiranyl]-2-hydroxyethyl]-3,4,4aα,5,6α,7,8,8a-octahydro-5β,6α,8aβ-trimethyl-1-naphthalenecarbaldehyde
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CAS No:
(4aS)-5-[(R)-2-[(S)-2-[(S)-1,2-Dihydroxyethyl]oxiranyl]-2-hydroxyethyl]-3,4,4aα,5,6,7,8,8a-octahydro-5β,6α,8aβ-trimethyl-1-naphthalenecarbaldehyde Basic Attributes
352.46508
352.225
Computed Properties
Molecular Weight:352.5
XLogP3:1.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:352.22497412
Monoisotopic Mass:352.22497412
Topological Polar Surface Area:90.3
Heavy Atom Count:25
Complexity:560
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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