Widdrol

Compound Structure:

Synonyms:

6892-80-4 ;(7S,9aS)-4,4,7,9a-tetramethyl-1,2,3,6,8,9-hexahydrobenzo[7]annulen-7-ol ;1H-Benzocyclohepten-7-ol, 2,3,4,4a,5,6,7,8-octahydro-1,1,4a,7-tetramethyl-, cis- ;SCHEMBL6519819

Compound ID:

NMPC-1595

PubChem ID:

94334

Molecular Formula:

C15H26O

Canonical SMILES:

CC1(CCCC2(C1=CCC(CC2)(C)O)C)C

InChIKey:

BXGVVQADPFXGHD-LSDHHAIUSA-N

About the compound:

Properties:

Computed Properties

Property Name	Property Value
Molecular Weight	222.37 g/mol
XLogP3-AA	4.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	222.198365449 g/mol
Monoisotopic Mass	222.198365449 g/mol
Topological Polar Surface Area	20.2Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	315
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Source:PubChem

Source Species:

Taxodium distichum
Murraya Koenigii

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