| (2R)-4-Amino-2-Azaniumyl-4-Oxobutanoate |
OC(=N)C[C@H](C(=O)O)N |
132.119 |
6991971 |
NPC153370 |
| Ellipticine |
CC1=C2C=CN=CC2=C(C3=C1NC4=CC=CC=C43)C |
246.31 |
3213 |
NPC215584 |
| Acrylamide |
C=CC(=O)N |
71.08 |
6579 |
NPC32955 |
| 5-(Methoxymethyl)-2-furaldehyde |
COCC1=CC=C(O1)C=O |
140.14 |
74711 |
NPC215377 |
| Sarsasapogenin |
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)O)C)C)C)OC1 |
416.6 |
92095 |
NPC248944 |
| Dioscin |
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CCC(C6)OC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)C)O)O)O)O)OC9C(C(C(C(O9)C)O)O)O)C)C)C)OC1 |
869 |
119245 |
NPC46190 |
| Aspafilioside C |
CC1C2C(CC3C2(CCC4C3CCC5C4(CCC(C5)OC6C(C(C(C(O6)COC7C(C(C(CO7)O)O)O)OC8C(C(C(CO8)O)O)O)O)O)C)C)OC1(CCC(C)COC9C(C(C(C(O9)CO)O)O)O)O |
1023.2 |
148363 |
NPC181810 |
| 5-Hydroxymethylfurfural |
C1=C(OC(=C1)C=O)CO |
126.11 |
237332 |
NPC107482 |
| (25S)-5beta-spirostan-3beta-yl beta-D-glucoside |
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)CO)O)O)O)C)C)C)OC1 |
578.8 |
440454 |
NPC190830 |
| Protodioscin |
CC1C2C(CC3C2(CCC4C3CC=C5C4(CCC(C5)OC6C(C(C(C(O6)CO)OC7C(C(C(C(O7)C)O)O)O)O)OC8C(C(C(C(O8)C)O)O)O)C)C)OC1(CCC(C)COC9C(C(C(C(O9)CO)O)O)O)O |
1049.2 |
441891 |
NPC39591 |
| Coniferyl Alcohol |
COC1=C(C=CC(=C1)C=CCO)O |
180.2 |
1549095 |
NPC139617 |
| 4-[(1Z,3S)-3-(4-hydroxyphenyl)penta-1,4-dienyl]phenol |
C=CC(C=CC1=CC=C(C=C1)O)C2=CC=C(C=C2)O |
252.31 |
5281830 |
NPC98382 |
| (9S,16S,18R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-ol |
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)O)C)C)C)OC1 |
416.6 |
5321139 |
NPC317207 |
| Hinokiresinol |
C=CC(C=CC1=CC=C(C=C1)O)C2=CC=C(C=C2)O |
252.31 |
5377291 |
NPC82664 |
| Sitogluside |
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C |
576.8 |
5742590 |
NPC243728 |
| Acrylamide, (Z)- |
CC(C)(C)SC=CC(=O)N |
159.25 |
6063118 |
NPC219530 |
| Nyasol |
C=CC(C=CC1=CC=C(C=C1)O)C2=CC=C(C=C2)O |
252.31 |
6438674 |
NPC132271 |
| (Z)-1,3-Bis(4-hydroxyphenyl)-1,4-pentadiene |
C=CC(C=CC1=CC=C(C=C1)O)C2=CC=C(C=C2)O |
252.31 |
6440617 |
NPC207356 |
| (-)-Nyasol |
C=CC(C=CC1=CC=C(C=C1)O)C2=CC=C(C=C2)O |
252.31 |
6915833 |
NPC292730 |
| (2S)-4-amino-2-ammonio-4-oxobutanoate |
C(C(C(=O)[O-])[NH3+])C(=O)N |
132.12 |
6992089 |
NPC34908 |
| Asparenydiol |
C1=CC(=CC=C1C#CC=CCOC2=CC=C(C=C2)O)O |
266.29 |
10084256 |
NPC266932 |
| 5-[(1E)-1-(4-hydroxyphenyl)penta-1,4-dien-3-yl]-2-methoxyphenol |
COC1=C(C=C(C=C1)C(C=C)C=CC2=CC=C(C=C2)O)O |
282.3 |
11312084 |
NPC235779 |
| Asparacosin A |
CC1CCC2(C(C3(C(O2)CC4C3(C(CC5C4CCC6=CC(=O)CCC56C)O)C)O)C)OC1 |
444.6 |
11385250 |
NPC178981 |
| 3''-Methoxyasparenydiol |
COC1=C(C=CC(=C1)C#CC=CCOC2=CC=C(C=C2)O)O |
296.3 |
11738011 |
NPC74478 |
| (-)-Hinokiresinol |
C=CC(C=CC1=CC=C(C=C1)O)C2=CC=C(C=C2)O |
252.31 |
12310493 |
NPC216520 |
| 1,2-dimethyl-4-[(E)-prop-1-enyl]benzene |
CC=CC1=CC(=C(C=C1)C)C |
146.23 |
15304515 |
NPC318650 |
| Asparacoside |
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)COC8C(C(C(CO8)O)O)O)OC9C(C(C(CO9)O)O)O)O)OC2C(C(C(C(O2)CO)O)O)O)C)C)C)OC1 |
1005.1 |
21575006 |
NPC128572 |
| Asparanin A |
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)CO)O)O)OC8C(C(C(C(O8)CO)O)O)O)C)C)C)OC1 |
740.9 |
21575007 |
NPC249204 |
| Asparacosin B |
CC1CCC2(C(C3(C(O2)CC4C3(C(=O)CC5C4CCC6C5(CCC(C6)(OC)OC)C)C)O)C)OC1 |
490.7 |
21575013 |
NPC178853 |
| 3'-Hydroxy-4'-methoxy-4'-dehydroxynyasol |
COC1=C(C=C(C=C1)C(C=C)C=CC2=CC=C(C=C2)O)O |
282.3 |
21575014 |
NPC281298 |
| Pseudoprotodioscin |
CC1C(C(C(C(O1)OC2C(OC(C(C2O)OC3C(C(C(C(O3)C)O)O)O)OC4CCC5(C6CCC7(C(C6CC=C5C4)CC8C7C(=C(O8)CCC(C)COC9C(C(C(C(O9)CO)O)O)O)C)C)C)CO)O)O)O |
1031.2 |
21637110 |
NPC87898 |
| 4-[(1Z)-1-(4-hydroxyphenyl)penta-1,4-dien-3-yl]-2-methoxyphenol |
COC1=C(C=CC(=C1)C(C=C)C=CC2=CC=C(C=C2)O)O |
282.3 |
25218067 |
NPC310338 |
| 1,3-Bis(4-hydroxyphenyl)-4-penten-1-one |
C=CC(CC(=O)C1=CC=C(C=C1)O)C2=CC=C(C=C2)O |
268.31 |
44575609 |
NPC322197 |
| (2S,3R,4S,5R,6S)-2-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(1R,2S,4S,5'S,6R,7S,8R,9S,12S,13S,16S,18R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol |
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)CO)O)O)OC8C(C(C(C(O8)CO)O)O)O)C)C)C)OC1 |
740.9 |
44583984 |
NPC297348 |
| (3R,8R,9R,10S,13R,14R,17R)-17-[(E,2R,5R)-5-ethyl-6-methylhept-3-en-2-yl]-3,10,13-trimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene |
CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)C)C)C)C(C)C |
410.7 |
50930798 |
NPC196776 |
| (2S,3R,4R,5R,6S)-2-[(2R,3S,4S,5R,6R)-4-hydroxy-2-(hydroxymethyl)-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-6-[[(1S,2S,4S,8S,9S,12S,13R)-7,9,13-trimethyl-6-[(3R)-3-methyl-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-6,18-dien-16-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol |
CC1C(C(C(C(O1)OC2C(OC(C(C2O)OC3C(C(C(C(O3)C)O)O)O)OC4CCC5(C6CCC7(C(C6CC=C5C4)CC8C7C(=C(O8)CCC(C)COC9C(C(C(C(O9)CO)O)O)O)C)C)C)CO)O)O)O |
1031.2 |
51346147 |
NPC168101 |
| 26-O-beta-D-glucopyranosyl-3beta,26-dihydroxy-25(R)-furosta-5,20(22)-dien-3-O-alpha-L-rhamnopyranosyl(1-2)-[alpha-L-rhamnopyranosyl(1-4)]-beta-D-glucopyranoside |
CCC1C(CC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)OC6C(C(C(C(O6)C)O)O)O)O)OC7C(C(C(C(O7)C)O)O)O)C)C)OC(=C)CCC(C)COC8C(C(C(C(O8)CO)O)O)O |
1047.2 |
52931426 |
NPC70314 |
| 3-O-(Rhaa1-4(Rhaa1-2)Glcb)-(25R)-spirost-5-en-3beta-ol |
CCC1C(CC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)OC6C(C(C(C(O6)C)O)O)O)O)OC7C(C(C(C(O7)C)O)O)O)C)C)OC8(CCC(CO8)C)C |
885.1 |
52931449 |
NPC4925 |
| 3-O-(Glcb1-3(Rhaa1-2)Glcb)-(25R)-spirost-5-en-3beta-ol |
CCC1C(CC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)OC6C(C(C(C(O6)CO)O)O)O)OC7C(C(C(C(O7)C)O)O)O)C)C)OC8(CCC(CO8)C)C |
901.1 |
52931453 |
NPC158823 |
| 22-epi-Yamogenin |
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CCC(C6)O)C)C)C)OC1 |
414.6 |
53486205 |
NPC273855 |
| (1R,2S,4R,6R,7S,8R,9S,12S,13S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-ol |
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)O)C)C)C)OC1 |
416.6 |
53486207 |
NPC47319 |
| (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate |
COC1=C(C=CC(=C1)C=CC(=O)O)[O-] |
193.18 |
54691413 |
NPC70741 |
| (2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5R,6R)-4-hydroxy-2-(hydroxymethyl)-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-6-[[(1S,2S,4S,8S,9S,12S,13R,16S)-7,9,13-trimethyl-6-[(3R)-3-methyl-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-6,18-dien-16-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol |
CC1C(C(C(C(O1)OC2C(OC(C(C2O)OC3C(C(C(C(O3)C)O)O)O)OC4CCC5(C6CCC7(C(C6CC=C5C4)CC8C7C(=C(O8)CCC(C)COC9C(C(C(C(O9)CO)O)O)O)C)C)C)CO)O)O)O |
1031.2 |
102004851 |
NPC293444 |
| (16S)-17-[(Z)-2-Methyl-2-butenoyloxy]-12beta,16-dihydroxykauran-18-oic acid |
CC=C(C)C(=O)OCC1(CC23CCC4C(C2CC(C1C3)O)(CCCC4(C)C(=O)O)C)O |
434.6 |
102056175 |
NPC34176 |
| 12beta-[(Z)-2-Methyl-2-butenoyloxy]kaur-16-en-18-oic acid |
CC=C(C)C(=O)OC1CC2C3(CCCC(C3CCC24CC1C(=C)C4)(C)C(=O)O)C |
400.5 |
102056176 |
NPC83296 |
| (16R)-16,17-Epoxy-9beta-hydroxy-12beta-[(Z)-2-methyl-2-butenoyloxy]kauran-19-oic acid |
CC=C(C)C(=O)OC1CC2(C3(CCCC(C3CCC24CC1C5(C4)CO5)(C)C(=O)O)C)O |
432.5 |
102056177 |
NPC237461 |
| (16S)-9,12beta,16-Trihydroxy-17-[(E)-2-methyl-2-butenoyloxy]kauran-19-oic acid |
CC=C(C)C(=O)OCC1(CC23CCC4C(CCCC4(C2(CC(C1C3)O)O)C)(C)C(=O)O)O |
450.6 |
102056179 |
NPC93950 |
| (3R)-1,3-bis(4-hydroxyphenyl)pent-4-en-1-one |
C=C[C@@H](CC(=O)C1=CC=C(C=C1)O)C2=CC=C(C=C2)O |
268.31 |
162882511 |
NPC255038 |
| 5-[(1Z,3S)-1-(4-hydroxyphenyl)penta-1,4-dien-3-yl]-2-methoxyphenol |
COC1=C(C=C(C=C1)[C@@H](C=C)/C=C\C2=CC=C(C=C2)O)O |
282.3 |
163071737 |
NPC24469 |
| (1'S,2R,4'S,5'R,9'R,10'S,12'R,13'S)-10'-hydroxy-5',9'-dimethyl-12'-[(Z)-2-methylbut-2-enoyl]oxyspiro[oxirane-2,14'-tetracyclo[11.2.1.01,10.04,9]hexadecane]-5'-carboxylic acid |
C/C=C(/C)\C(=O)O[C@@H]1C[C@]2([C@@]3(CCC[C@@]([C@H]3CC[C@@]24C[C@@H]1[C@]5(C4)CO5)(C)C(=O)O)C)O |
432.5 |
162945730 |
NPC24795 |
| (1S,4S,5S,9R,10S,12R,13S,14S)-10,12,14-trihydroxy-5,9-dimethyl-14-(2-methylbut-2-enoyloxymethyl)tetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid |
CC=C(C)C(=O)OC[C@@]1(C[C@@]23CC[C@@H]4[C@@](CCC[C@]4([C@@]2(C[C@H]([C@@H]1C3)O)O)C)(C)C(=O)O)O |
450.6 |
162938797 |
NPC226945 |
| (3R,4S,5S,6R)-2-[[(3S,8S,9S,10R,13R,14S)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol |
CC[C@H](CC[C@@H](C)C1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)C)C)C(C)C |
576.8 |
52940117 |
NPC142753 |