(4S,4aS,6aS,7aR,8S,8aR,9aR,9bS)-Tetradecahydro-4,7a,9b-trimethyl-6a,8-methano-6aH-cyclopropa[b]phenanthrene-4-carboxylic acid
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![(4S,4aS,6aS,7aR,8S,8aR,9aR,9bS)-Tetradecahydro-4,7a,9b-trimethyl-6a,8-methano-6aH-cyclopropa[b]phenanthrene-4-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/07100ea58b78424cba38daa80de0b327.png "(4S,4aS,6aS,7aR,8S,8aR,9aR,9bS)-Tetradecahydro-4,7a,9b-trimethyl-6a,8-methano-6aH-cyclopropa[b]phenanthrene-4-carboxylic acid")
(4S,4aS,6aS,7aR,8S,8aR,9aR,9bS)-Tetradecahydro-4,7a,9b-trimethyl-6a,8-methano-6aH-cyclopropa[b]phenanthrene-4-carboxylic acid
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CAS No:
26263-39-8
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Formula:
C20H30O2
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Chemical Name:
(4S,4aS,6aS,7aR,8S,8aR,9aR,9bS)-Tetradecahydro-4,7a,9b-trimethyl-6a,8-methano-6aH-cyclopropa[b]phenanthrene-4-carboxylic acid
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Synonyms:
6a,8-Methano-6aH-cyclopropa[b]phenanthrene-4-carboxylic acid,tetradecahydro-4,7a,9b-trimethyl-,(4S,4aS,6aS,7aR,8S,8aR,9aR,9bS)-;Trachyloban-18-oic acid,(4β)-;(4S,4aS,6aS,7aR,8S,8aR,9aR,9bS)-Tetradecahydro-4,7a,9b-trimethyl-6a,8-methano-6aH-cyclopropa[b]phenanthrene-4-carboxylic acid;Trachyloban-19-oic acid;Trachylobanic acid;Trachylobanoic acid;6a,8-Methano-6aH-cyclopropa[b]phenanthrene-4-carboxylic acid,tetradecahydro-4,7a,9b-trimethyl-,[4S-(4α,4aα,6aβ,7aα,8β,8aα,9aα,9bβ)]-;(4β)-Trachyloban-18-oic acid;ent-Trachyloban-18-oic acid
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CAS No:
(4S,4aS,6aS,7aR,8S,8aR,9aR,9bS)-Tetradecahydro-4,7a,9b-trimethyl-6a,8-methano-6aH-cyclopropa[b]phenanthrene-4-carboxylic acid Basic Attributes
302.5 g/mol
302.45
Computed Properties
Molecular Weight:302.5
XLogP3:5.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:302.224580195
Monoisotopic Mass:302.224580195
Topological Polar Surface Area:26.3
Heavy Atom Count:22
Complexity:542
Defined Atom Stereocenter Count:7
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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