TCMBANKIN026671 |
matteucinin |
|
C30H38O15 |
0 |
CC1=C(C2=C(C(=C1OC3C(C(C(C(O3)COC4C(C(C(C(O4)CO)O)O)O)O)O)O)C)OC(CC2=O)C5=CC=C(C=C5)OC)O |
TCMBANKIN041497 |
19,24-dihydroxyurs-12-en-3-one-28-oic acid |
19,24-dihydroxyurs-12-en-3-one-28-oicacid |
C30H46O5 |
|
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(=O)C5(C)CO)C)C)C2C1(C)O)C)C(=O)O |
TCMBANKIN059002 |
Grayanotoxin I |
ACon0_000384; 135912-EP2277880A1; MEGxp0_001761; Acetylandromedol; (3beta,6beta,14R)-Grayanotoxane-3,5,6,10,14,16-hexol, 14-acetate; G-I; NP-010017; NCGC00168796-02_C22H36O7_Grayanotoxane-3,5,6,10,14,16-hexol, 14-acetate, (3beta,6beta,14R,16alpha)-; GRAYANOTOXIN I; ZINC3978484; NCGC00168796-01; Grayanotoxane-3,5,6,10,14,16-hexol 14-acetate; 4720/9/6; SCHEMBL3229044; GTX-I; 7,9a-Methano-9aH-cyclopenta(b)heptalene-2,4,8,11,11a,12(1H)-hexol-, dodecahydro-1,1,4,8-tetramethyl-, 12-acetate, (2S,3aS,4aR,7R,8R,9aS,11R,11aR,12R)-; HSDB 3463; 135912-EP2292610A1; Rhodotoxine; Rhodotoxin; Asebotoxin; W4E6HC3T2B; BRN 2065643; Perhydro-2beta,4alpha,8alpha,11beta,11abeta-pentahydroxy-1,1,4,8-tetramethyl-7,9a-methano-9aalphaH-cyclopenta(b)heptalen-12beta-yl acetat; Andromedotoxin; UNII-W4E6HC3T2B; CHEMBL3085397; Grayanotoxane-3,5,6,10,14,16-hexol, 14-acetate, (3beta,6beta,14R)- (9CI); ACon1_000099; AKOS027326735; CHEBI:5542; AK322338; Perhydro-2beta,4alpha,8alpha,11beta,11abeta-pentahydroxy-1,1,4,8-tetramethyl-7,9a-methano-9aalphaH-cyclopenta(b)heptalen-12beta-yl acetate; 7,9a-Methano-9aH-cyclopenta(b)heptalene-2,4,8,11,11a,12(1H)-hexol, dodecahydro-1,1,4,8-tetramethyl-, 12-acetate (2S,3as,4R,4ar,7R,8R,9as,11R,11aR,12R)-; NSC 26711; (14R)-3beta,5,6beta,10,16-pentahydroxygrayanotoxan-14-yl acetate; C09103; 4720-09-6 |
C22H36O7 |
412.5 g/mol |
CC(=O)OC1C2CCC3C1(CC(C4(C(C3(C)O)CC(C4(C)C)O)O)O)CC2(C)O |
TCMBANKIN059742 |
7-o-β-d-apiofuranosyl-(1→6)-β-d-glucopyra-nosylmatteucinol |
|
C29H36O14 |
|
CC1=C(C2=C(C(=C1OC3C(C(C(C(O3)COC4C(C(CO4)(CO)O)O)O)O)O)C)OC(CC2=O)C5=CC=C(C=C5)OC)O |
TCMBANKIN012498 |
cyanin |
LMPK12010113; Cyanidin 3,5-diglucoside; cyanine; Cyanin |
C27H31O16+ |
611.5 g/mol |
C1=CC(=C(C=C1C2=C(C=C3C(=CC(=CC3=[O+]2)O)OC4C(C(C(C(O4)CO)O)O)O)OC5C(C(C(C(O5)CO)O)O)O)O)O |
TCMBANKIN013955 |
chrysanthemol |
chrysanthemol ; ZINC15208543; MolPort-044-723-367; (+)-Chrysanthemol[terpene] |
C10H18O |
154.25 g/mol |
CC(=CC1C(C1(C)C)CO)C |
TCMBANKIN016517 |
malvin |
|
C29H35O17+ |
655.6 g/mol |
COC1=CC(=CC(=C1O)OC)C2=C(C=C3C(=CC(=CC3=[O+]2)O)OC4C(C(C(C(O4)CO)O)O)O)OC5C(C(C(C(O5)CO)O)O)O |
TCMBANKIN023167 |
5-methylol-3H-furan-2-one |
5-(hydroxymethyl)-3H-furan-2-one |
|
114.11 |
|
TCMBANKIN023519 |
Malvidin-3,5-diglucoside |
malvidin-3,5-diglucoside |
C29H35ClO17 |
691 g/mol |
COC1=CC(=CC(=C1O)OC)C2=C(C=C3C(=CC(=CC3=[O+]2)O)OC4C(C(C(C(O4)CO)O)O)O)OC5C(C(C(C(O5)CO)O)O)O.[Cl-] |
TCMBANKIN026671 |
matteucinin |
|
C30H38O15 |
0 |
CC1=C(C2=C(C(=C1OC3C(C(C(C(O3)COC4C(C(C(C(O4)CO)O)O)O)O)O)O)C)OC(CC2=O)C5=CC=C(C=C5)OC)O |
TCMBANKIN036093 |
2α,23-dihydroxy-3β-sulfoxyolean-12-en-28-oicacid o-α-l-rhamnopyranosyl-(1→4)-o-β-d-glucopyranosyl-(1→6)-β-d-glucopyranosylester sodium salt |
|
C48H78O22S |
|
CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OCC3C(C(C(C(O3)OC(=O)C45CCC(CC4C6=CCC7C(C6(CC5)C)(CCC8C7(CC(C(C8(C)CO)OS(=O)(=O)O)O)C)C)(C)C)O)O)O)CO)O)O)O |
TCMBANKIN039603 |
Peonin |
peonin; peonidin 3,5-diglucoside; Peonidin 3-glucoside-5-glucoside; LMPK12010238; SCHEMBL317322 |
C28H33O16+ |
625.6 g/mol |
COC1=C(C=CC(=C1)C2=C(C=C3C(=CC(=CC3=[O+]2)O)OC4C(C(C(C(O4)CO)O)O)O)OC5C(C(C(C(O5)CO)O)O)O)O |
TCMBANKIN040915 |
Matteucinol |
|
C18H18O5 |
314.333 |
c1(O[H])c(C([H])([H])[H])c(O[C@@]([H])(c2c([H])c([H])c(OC([H])([H])[H])c([H])c2[H])C([H])([H])C3=O)c3c(O[H])c1C([H])([H])[H] |
TCMBANKIN044562 |
l-beta-cyanolanine |
|
|
114.103 |
|
TCMBANKIN058126 |
chrysanthemin |
cyanidin-3-glucoside; Chrysanthemin; LMPK12010110; cyanidin 3-glucoside; Cyanidin 3-O-glucoside; cyanidin 3-o-glucoside; cyanidin-3-O-glucoside |
C28H58O |
410.76 |
C1=CC(=C(C=C1C2=[O+]C3=CC(=CC(=C3C=C2OC4C(C(C(C(O4)CO)O)O)O)O)O)O)O |
TCMBANKIN058569 |
mallotusinin |
mauotusinin |
C41H26O25 |
918.6 g/mol |
C1C2C3C(C(C(O2)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C6=C5C7=C(O6)C(=C(C=C7C(=O)O3)O)O)O)O)OC(=O)C8=CC(=C(C(=C8C9=C(C(=C(C=C9C(=O)O1)O)O)O)O)O)O |
TCMBANKIN059002 |
Grayanotoxin I |
ACon0_000384; 135912-EP2277880A1; MEGxp0_001761; Acetylandromedol; (3beta,6beta,14R)-Grayanotoxane-3,5,6,10,14,16-hexol, 14-acetate; G-I; NP-010017; NCGC00168796-02_C22H36O7_Grayanotoxane-3,5,6,10,14,16-hexol, 14-acetate, (3beta,6beta,14R,16alpha)-; GRAYANOTOXIN I; ZINC3978484; NCGC00168796-01; Grayanotoxane-3,5,6,10,14,16-hexol 14-acetate; 4720/9/6; SCHEMBL3229044; GTX-I; 7,9a-Methano-9aH-cyclopenta(b)heptalene-2,4,8,11,11a,12(1H)-hexol-, dodecahydro-1,1,4,8-tetramethyl-, 12-acetate, (2S,3aS,4aR,7R,8R,9aS,11R,11aR,12R)-; HSDB 3463; 135912-EP2292610A1; Rhodotoxine; Rhodotoxin; Asebotoxin; W4E6HC3T2B; BRN 2065643; Perhydro-2beta,4alpha,8alpha,11beta,11abeta-pentahydroxy-1,1,4,8-tetramethyl-7,9a-methano-9aalphaH-cyclopenta(b)heptalen-12beta-yl acetat; Andromedotoxin; UNII-W4E6HC3T2B; CHEMBL3085397; Grayanotoxane-3,5,6,10,14,16-hexol, 14-acetate, (3beta,6beta,14R)- (9CI); ACon1_000099; AKOS027326735; CHEBI:5542; AK322338; Perhydro-2beta,4alpha,8alpha,11beta,11abeta-pentahydroxy-1,1,4,8-tetramethyl-7,9a-methano-9aalphaH-cyclopenta(b)heptalen-12beta-yl acetate; 7,9a-Methano-9aH-cyclopenta(b)heptalene-2,4,8,11,11a,12(1H)-hexol, dodecahydro-1,1,4,8-tetramethyl-, 12-acetate (2S,3as,4R,4ar,7R,8R,9as,11R,11aR,12R)-; NSC 26711; (14R)-3beta,5,6beta,10,16-pentahydroxygrayanotoxan-14-yl acetate; C09103; 4720-09-6 |
C22H36O7 |
412.5 g/mol |
CC(=O)OC1C2CCC3C1(CC(C4(C(C3(C)O)CC(C4(C)C)O)O)O)CC2(C)O |
TCMBANKIN059742 |
7-o-β-d-apiofuranosyl-(1→6)-β-d-glucopyra-nosylmatteucinol |
|
C29H36O14 |
|
CC1=C(C2=C(C(=C1OC3C(C(C(C(O3)COC4C(C(CO4)(CO)O)O)O)O)O)C)OC(CC2=O)C5=CC=C(C=C5)OC)O |
TCMBANKIN061030 |
Methyl myristate |
|
C15H30O2 |
242.4 g/mol |
CCCCCCCCCCCCCC(=O)OC |