Results for:
chemical Classification: chromanes

6-hydroxy-4,4,7,8-tetramethyl-3H-chromen-2-one

Compound Details

Synonymous names	SCHEMBL7022698 AQPMOJIQTWUGGG-UHFFFAOYSA-N 3,4-dihydro-4,4,7,8-tetramethylcoumarin-6-ol 6-Hydroxy-4,4,7,8-tetramethyl-2-chromanone # Coumarin-6-ol, 3,4-dihydro-4,4,7,8-tetramethyl-
Microorganism:	Yes
IUPAC name	6-hydroxy-4,4,7,8-tetramethyl-3H-chromen-2-one
SMILES	CC1=C(C=C2C(=C1C)OC(=O)CC2(C)C)O
Inchi	InChI=1S/C13H16O3/c1-7-8(2)12-9(5-10(7)14)13(3,4)6-11(15)16-12/h5,14H,6H2,1-4H3
Formula	C13H16O3
PubChem ID	601438
Molweight	220.26
LogP	2.9
Atoms	16
Bonds	0
H-bond Acceptor	3
H-bond Donor	1
Chemical Classification	heterocyclic compounds chromanes benzenoids lactones aromatic compounds esters phenols

mVOC Specific Details

Species emitting the compound	Kingdom Species Biological Function Origin/Habitat Reference Eukaryota Saccharomyces Cerevisiae NA NA Harris et al. 2021
Method	Kingdom Species Growth Medium Applied Method Verification Eukaryota Saccharomyces Cerevisiae malt extract broth HS-SPME with GC-MS no

5-hydroxy-2-methyl-2,3-dihydrochromen-4-one

Compound Details

Synonymous names	14153-17-4 5-Hydroxy-2-methyl-4-chromanone 5-hydroxy-2-methylchroman-4-one 4H-1-Benzopyran-4-one, 2,3-dihydro-5-hydroxy-2-methyl- 5-hydroxy-2-methyl-2,3-dihydrochromen-4-one 2,3-dihydro-5-hydroxy-2-methyl-4h-1-benzopyran-4-one 5-hydroxy-2-methyl-3,4-dihydro-2H-1-benzopyran-4-one DTXSID10536587 DB-229384 J-007511 5-Hydroxy-2-methyl-2,3-dihydro-4H-1-benzopyran-4-one 5-HYDROXY-2-METHYL-2,3-DIHYDRO-1-BENZOPYRAN-4-ONE
Microorganism:	No
IUPAC name	5-hydroxy-2-methyl-2,3-dihydrochromen-4-one
SMILES	CC1CC(=O)C2=C(C=CC=C2O1)O
Inchi	InChI=1S/C10H10O3/c1-6-5-8(12)10-7(11)3-2-4-9(10)13-6/h2-4,6,11H,5H2,1H3
Formula	C10H10O3
PubChem ID	13316455
Molweight	178.18
LogP	2
Atoms	13
Bonds	0
H-bond Acceptor	3
H-bond Donor	1
Chemical Classification	aromatic compounds chromanes phenols benzenoids esters
CHEBI-ID	217311
Supernatural-ID	SN0410192

mVOC Specific Details

Species emitting the compound	Kingdom Species Biological Function Origin/Habitat Reference Eukaryota Hypoxylon Invadens NA Dickschat et al. 2018
Method	Kingdom Species Growth Medium Applied Method Verification Eukaryota Hypoxylon Invadens YMG medium CSLA-GCMS no

3,4-dihydro-2H-chromen-4-ol

Mass-Spectra

Compound Details

Synonymous names	4-Chromanol 1481-93-2 Chroman-4-ol 3,4-Dihydro-2H-1-benzopyran-4-ol 4-Hydroxychroman 2H-1-Benzopyran-4-ol, 3,4-dihydro- 3,4-dihydro-2H-chromen-4-ol MFCD00006849 3'-carboxy-alpha-chromanol NSC654113 EINECS 216-041-4 2H-1-Benzopyran-4-ol,3,4-dihydro- 4-Chromanol, >=99% SCHEMBL131445 CHEMBL1984537 DTXSID40933308 CHEBI:179658 HMS1664N08 BAA48193 STL553702 AKOS000249320 AKOS016370832 MCULE-4768713856 NSC-654113 NCI60_018816 SY027475 DB-042919 C1627 EU-0068044 NS00044213 A12066 EN300-156550 A884372 SR-01000399399 J-008450 SR-01000399399-1 Z335244980
Microorganism:	No
IUPAC name	3,4-dihydro-2H-chromen-4-ol
SMILES	C1COC2=CC=CC=C2C1O
Inchi	InChI=1S/C9H10O2/c10-8-5-6-11-9-4-2-1-3-7(8)9/h1-4,8,10H,5-6H2
Formula	C9H10O2
PubChem ID	92890
Molweight	150.17
LogP	1.2
Atoms	11
Bonds	0
H-bond Acceptor	2
H-bond Donor	1
Chemical Classification	alcohols benzenoids heterocyclic compounds chromanes ethers
CHEBI-ID	179658
Supernatural-ID	SN0225202

mVOC Specific Details

Solubility

2.93e+01 g/l Literature: ALOGPS

Species emitting the compound	Kingdom Species Biological Function Origin/Habitat Reference Eukaryota Tuber Melanosporum n/a Agricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain). Diaz et al. 2003 Eukaryota Tuber Melanosporum Agricultural Centre of Castilla and León Community Diaz et al. 2003
Method	Kingdom Species Growth Medium Applied Method Verification Eukaryota Tuber Melanosporum n/a n/a no Eukaryota Tuber Melanosporum no