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Synonyms (4)
Vendors (2)
Annotations (4)
Representations (1)
Notes (0)
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Analogs (6)

ZINC15657750

15657750

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Substance Information

In ZINC since	Heavy atoms	Benign functionality
July 28^th, 2008	21	Yes

Popular Name: MANOOL MANOOL

Find On: PubMed — Wikipedia — Google

CAS Number: 596-85-0

Other Names:

(+)-manool; (13R)-Labda-8(20),14-dien-13-ol; (13R)-labda-8(27),14-dien-13-ol; (13R)-manool; (5S,9S,10S,13R)-labda-8(17),14-dien-13-ol; labda-8(17),14-dien-13(R)-ol; manool

1-Naphthalenepropanol, alpha-ethenyldecahydro-alpha,5,5,8a-tetramethyl-2-methylene-, (1S-(1alpha(S*),4abeta,8aalpha))-; 3-methyl-5-(5,5,8a-trimethyl-2-methylenedecahydronaphthalen-1-yl)pent-1-en-3-ol; 3-methyl-5-(5,5,8a-trimethyl-2-methylidenedecahydronap

SMILES:

Download: MOL2 SDF SMILES Flexibase

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Vendors

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.71	8.89	-1.22	1	1	0	20	290.491	4	↓ MOL2 SDF SMILES Flexibase

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Analogs ( Draw Identity 99% 90% 80% 70% )

Synonyms (4)
Vendors (2)
Annotations (4)
Representations (1)
Notes (0)
Targets (0)
Clustered (0)
Reactome (0)
Rings (0)
Analogs (6)