Manool
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Manool
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CAS No:
596-85-0
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Formula:
C20H34O
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Chemical Name:
Manool
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Synonyms:
1-Naphthalenepropanol,α-ethenyldecahydro-α,5,5,8a-tetramethyl-2-methylene-,(αR,1S,4aS,8aS)-;Labda-8(20),14-dien-13-ol,(13R)-;Manool;1-Naphthalenepropanol,α-ethenyldecahydro-α,5,5,8a-tetramethyl-2-methylene-,[1S-[1α(S*),4aβ,8aα]]-;(αR,1S,4aS,8aS)-α-Ethenyldecahydro-α,5,5,8a-tetramethyl-2-methylene-1-naphthalenepropanol;NSC 165961;Labd-8(17),14-dien-13-ol
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CAS No:
Description
ChEBI: A labdane diterpenoid in which the labdane skeleton has double bonds at positions 8(17) and 14 and carries an R-hydroxy group at position 13.
Safety Information
3
R36/37/38
S26-S36
Xi: Irritant;
P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P391, P403+P233, P405, P501
H315
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P391, P403+P233, P405, and P501|Aggregated GHS information provided by 40 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Manool Use and Manufacturing
Maintains anti-proliferative activity against human malignant cell strains.
Computed Properties
Molecular Weight:290.5
XLogP3:5.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:290.260965704
Monoisotopic Mass:290.260965704
Topological Polar Surface Area:20.2
Heavy Atom Count:21
Complexity:422
Defined Atom Stereocenter Count:3
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes