Results for:
chemical Classification: flavonols

(2R,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol

Mass-Spectra

Compound Details

Synonymous names
Cianidanol
(+)-catechin
CATECHIN
154-23-4
Catechuic acid
Catechinic acid
Cyanidanol
D-Catechin
Catergen
Cianidol
(+)-Catechol
(+)-Cyanidanol
Biocatechin
(+)-Cyanidan-3-ol
D-Catechol
D-(+)-Catechin
Dexcyanidanol
Catechin (flavan)
Catechol (flavan)
(+)-Catechin Hydrate
(2R,3S)-Catechin
(2R,3S)-2-(3,4-Dihydroxyphenyl)chroman-3,5,7-triol
3-Cyanidanol, (+)-
Cianidanolum
Transepar
(2R,3S)-(+)-Catechin
DL-Catechin
dl-Catechol
(2R,3S)-2-(3,4-dihydroxyphenyl)chromane-3,5,7-triol
CCRIS 6855
7295-85-4
Catechin, d-
(+)-Cianidanol
3,3',4',5,7-Flavanpentol
KB-53
(+)-3',4',5,7-Tetrahydroxy-2,3-trans-flavan-3-ol
NSC 2819
NSC-2819
2,3-trans-catechin
(+)-Cyanidanol-3
(2R,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol
2,3-Dihydro-4-desoxoquercetin
CHEBI:15600
2H-1-Benzopyran-3,5,7-triol, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-, (2R-trans)-
Cianidanolum [INN-Latin]
AI3-22757
EINECS 205-825-1
(+)-(2R,3S)-5,7,3',4'-Tetrahydroxyflavan-3-ol
UNII-8R1V1STN48
Catechol (+)
(+/-)-Catechin
8R1V1STN48
NSC2819
(2R,3S)-3,3',4',5,7-Flavanpentol
CATECHIN, D
(2R,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol
2H-1-benzopyran-3,5,7-triol, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-, (2R,3S)-
Catechu
(2R-trans)-2-(3,4-Dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol
CHEMBL311498
DTXSID3022322
(+)-2-(3,4-Dihydroxyphenyl)-3,5,7-chromantriol
MFCD00075649
5J4Y243W61
100786-01-4
Gambier
Katha
trans-(+)-3,3',4',5,7-Flavanpentol
Zyma
Cianidanolum (INN-Latin)
Cyanidanol-3
CIANIDANOL (MART.)
CIANIDANOL [MART.]
(+)-Cyanidol-3
Cutch (dye)
(+)-(2R:3S)-5,7,3',4'-Tetrahydroxyflavan-3-ol
(+)-CATECHIN (USP-RS)
(+)-CATECHIN [USP-RS]
Catechin-(+,-) hydrate
Epicatechin-(-)
Catechin (hydrate)
Cianidanol [INN:JAN]
MLS001056745
(2R,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-1H-chromene-3,5,7-triol
Catechine dl-form
(+-)-catechin
(+/-)-catechol
KB 53
SR-01000075742
SMR000326724
Catechinate
Catechuate
Drenoliver
rac-catechin
Tanningenic acid
DL-Catechine
UNII-5J4Y243W61
(+)-Catechin;Cianidanol;Catechuic acid
Z 7300
Teafuran 30A
KXN
Prestwick_998
Sunkatol No. 1
EINECS 230-731-2
Slim 2
2-(3,4-Dihydroxyphenyl)chromane-3,5,7-triol
RACEMIC CATECHIN
Spectrum_000395
(+)-Catechin,(S)
2-(3,4-Dihydroxyphenyl)-3,5,7-chromanetriol #
CATECHIN [MI]
CATECHIN, DL-
CATECHIN [VANDF]
CIANIDANOL [INN]
CIANIDANOL [JAN]
Prestwick0_000642
Prestwick0_000817
Prestwick1_000642
Prestwick1_000817
Prestwick2_000642
Prestwick2_000817
Prestwick3_000642
Spectrum2_000167
Spectrum3_000242
Spectrum4_001763
Spectrum5_000345
Epitope ID:116872
(+/-)-Catechin xHydrate
CIANIDANOL [WHO-DD]
Lopac0_000219
SCHEMBL19741
BSPBio_000643
BSPBio_001624
KBioGR_002245
KBioSS_000875
8001-48-7
154-23-4 , anhydride
BIDD:ER0378
DivK1c_000647
SPBio_000033
SPBio_002564
SPBio_002634
CATECHIN DL-FORM [MI]
BPBio1_000709
cid_107957
DTXCID202322
(3S,2R)-2-(3,4-dihydroxyphenyl)chromane-3,5,7-triol
CATECHOL, (+/-)-
ACon1_001489
BDBM23416
BDBM60836
CIANIDANOL, (+/-)-
GTPL13091
HMS502A09
KBio1_000647
KBio2_000875
KBio2_003443
KBio2_006011
KBio3_001124
YK-85 Light Yellow Powder 85
4c94
NINDS_000647
DTXSID001349029
HMS1570A05
HMS1570D15
HMS2097A05
HMS3260L19
Pharmakon1600-00210205
(+)-Catechin, analytical standard
HY-N0898
TNP00270
Tox21_500219
CCG-40007
LMPK12020001
NSC755824
s3974
s4722
STL570276
trans3,3,4,5,7 pentahydroxyflavane
AKOS015960546
trans-2-(3,4-Dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol
CS-3759
DB14086
LP00219
MCULE-1532117250
ND-0342
NSC-755824
SDCCGMLS-0066526.P001
SDCCGSBI-0050207.P004
IDI1_000647
NCGC00017331-01
NCGC00017331-02
NCGC00017331-03
NCGC00017331-04
NCGC00017331-05
NCGC00017331-19
NCGC00093689-01
NCGC00093689-02
NCGC00093689-03
NCGC00260904-01
AC-11608
AC-35859
AS-72772
NCI60_002303
(+)-Catechin 1000 microg/mL in Acetone
SBI-0050207.P003
1ST000259
EU-0100219
NS00004541
( inverted exclamation markA)-Catechin hydrate
(+)-Catechin 1000 microg/mL in Acetonitrile
C 1251
C06562
D95105
H10916
AB00051886_13
EN300-6498629
(+/-)-Catechin 1000 microg/mL in Acetonitrile
A809512
A878497
NATURAL BROWN 3 (CUTCH EXTRA OR GAMBIER)
Q415007
(+)-CATECHIN (CONSTITUENT OF MARITIME PINE)
Q-100183
SR-01000075742-1
SR-01000075742-7
SR-01000075742-8
SR-01000075742-9
BRD-K58736316-001-07-9
BRD-K58736316-001-08-7
SR-01000075742-10
SR-01000075742-12
SR-01000075742-14
(+)-CATECHIN (CONSTITUENT OF MARITIME PINE) [DSC]
D4A04A57-7609-451F-A446-53F4DFAD15F5
(2R,3S)-2-(3,4-dihydroxyphenyl)chroman-3,5,7-triol;hydrate
(+)-Catechin, United States Pharmacopeia (USP) Reference Standard
(+)-CATECHIN (CONSTITUENT OF GRAPE SEEDS OLIGOMERIC PROANTHOCYANIDINS)
(+)-CATECHIN (CONSTITUENT OF POWDERED DECAFFEINATED GREEN TEA EXTRACT)
(+)-Catechin, Pharmaceutical Secondary Standard; Certified Reference Material
(2R,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol;hydrate
(2R,3S)-2-[3,4-bis(oxidanyl)phenyl]-3,4-dihydro-2H-chromene-3,5,7-triol;hydrate
(2R-trans)-2-(3,4-Dihydroxyphenyl)-3-4-dihydro-2H-1-benzopyran-3,5,7-triol
2-(3,4-Dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol, (2R-trans)
2H-1-Benzopyran-3,7-triol, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-, (2R-trans)-
2H-1-BENZOPYRAN-3,5,7-TRIOL, 2-(3,4-DIHYDROXYPHENYL)-3,4-DIHYDRO-, (2S,3R)-REL-
321-01-7
InChI=1/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15+/m0/s
Microorganism:

No

IUPAC name(2R,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol
SMILESC1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O
InchiInChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15+/m0/s1
FormulaC15H14O6
PubChem ID9064
Molweight290.27
LogP0.4
Atoms21
Bonds1
H-bond Acceptor6
H-bond Donor5
Chemical Classificationbenzenoids flavonoids aromatic compounds phenols diols ethers flavonols
CHEBI-ID15600
Supernatural-IDSN0284216-02

mVOC Specific Details

MS-Links
MS-MS Spectrum 179498
MS-MS Spectrum 5796 - LC-ESI-QTOF (UPLC Q-Tof Premier, Waters) Negative
MS-MS Spectrum 2129 - Quattro_QQQ 25V Negative delivery=Flow_Injection analyzer=Triple_Quad
MS-MS Spectrum 179497
MS-MS Spectrum 5795 - LC-ESI-QTOF (UPLC Q-Tof Premier, Waters) Positive
MS-MS Spectrum 179496
MS-MS Spectrum 201474
MS-MS Spectrum 201477
MS-MS Spectrum 226450
MS-MS Spectrum 201476
MS-MS Spectrum 181824
MS-MS Spectrum 201473
MS-MS Spectrum 181825
MS-MS Spectrum 201478
MS-MS Spectrum 201471
MS-MS Spectrum 2128 - Quattro_QQQ 10V Negative delivery=Flow_Injection analyzer=Triple_Quad
MS-MS Spectrum 201472
MS-MS Spectrum 226448
MS-MS Spectrum 226447
MS-MS Spectrum 201475
MS-MS Spectrum 181826
MS-MS Spectrum 226451
MS-MS Spectrum 226449
MS-MS Spectrum 2130 - Quattro_QQQ 40V Negative delivery=Flow_Injection analyzer=Triple_Quad
MS-MS Spectrum 226446
Massbank-Links
Massbank Spectrum MSBNK-BGC_Munich-RP017801
Massbank Spectrum MSBNK-BGC_Munich-RP017802
Massbank Spectrum MSBNK-BGC_Munich-RP017803
Massbank Spectrum MSBNK-BGC_Munich-RP017811
Massbank Spectrum MSBNK-BGC_Munich-RP017812
Massbank Spectrum MSBNK-BGC_Munich-RP017813
Massbank Spectrum MSBNK-BS-BS003013
Massbank Spectrum MSBNK-BS-BS003014
Massbank Spectrum MSBNK-BS-BS003015
Massbank Spectrum MSBNK-BS-BS003016
Massbank Spectrum MSBNK-IPB_Halle-PB001329
Massbank Spectrum MSBNK-IPB_Halle-PB001330
Massbank Spectrum MSBNK-IPB_Halle-PB001331
Massbank Spectrum MSBNK-IPB_Halle-PB001332
Massbank Spectrum MSBNK-IPB_Halle-PB002429
Massbank Spectrum MSBNK-IPB_Halle-PB002430
Massbank Spectrum MSBNK-IPB_Halle-PB002431
Massbank Spectrum MSBNK-IPB_Halle-PB002432
Massbank Spectrum MSBNK-RIKEN_ReSpect-PM000403
Massbank Spectrum MSBNK-RIKEN_ReSpect-PS045501
Massbank Spectrum MSBNK-RIKEN_ReSpect-PS045502
Massbank Spectrum MSBNK-RIKEN_ReSpect-PS045503
Massbank Spectrum MSBNK-RIKEN_ReSpect-PS045504
Massbank Spectrum MSBNK-RIKEN_ReSpect-PS045507
Massbank Spectrum MSBNK-RIKEN_ReSpect-PS045508
Massbank Spectrum MSBNK-RIKEN_ReSpect-PT104550
Massbank Spectrum MSBNK-RIKEN_ReSpect-PT204550
Massbank Spectrum MSBNK-RIKEN-PR100262
Massbank Spectrum MSBNK-RIKEN-PR100687
Massbank Spectrum MSBNK-RIKEN-PR302549
Massbank Spectrum MSBNK-RIKEN-PR302555
Massbank Spectrum MSBNK-RIKEN-PR302561
Massbank Spectrum MSBNK-RIKEN-PR302567
Massbank Spectrum MSBNK-RIKEN-PR302573
Massbank Spectrum MSBNK-RIKEN-PR302579
Massbank Spectrum MSBNK-RIKEN-PR302585
Massbank Spectrum MSBNK-RIKEN-PR302591
Massbank Spectrum MSBNK-RIKEN-PR302597
Massbank Spectrum MSBNK-RIKEN-PR302603
Massbank Spectrum MSBNK-RIKEN-PR302609
Massbank Spectrum MSBNK-RIKEN-PR302615

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaLentinus EdodesnaKoreaKim et al. 2008
EukaryotaAgaricus BlazeinaKoreaKim et al. 2008
EukaryotaGanoderma LucidumnaKoreaKim et al. 2008
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaLentinus EdodesnaHPLCyes
EukaryotaAgaricus BlazeinaHPLCyes
EukaryotaGanoderma LucidumnaHPLCyes