> Alkaloids and derivatives
|
7-Angelylretronecine
|
6440943 |
Click to see
CC=C(C)C(=O)OC1CCN2C1C(=CC2)CO
|
237.29 |
unknown |
via CMAUP database |
9-Angeloylretronecine
|
638872 |
Click to see
CC=C(C)C(=O)OCC1=CCN2C1C(CC2)O
|
237.29 |
unknown |
via CMAUP database |
> Benzenoids / Naphthalenes / Naphthoquinones
|
(R)-1-(5,8-Dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-4-methylpent-3-en-1-yl acetate
|
479501 |
Click to see
CC(=CCC(C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O)OC(=O)C)C
|
330.30 |
unknown |
via CMAUP database |
5,8-Dihydroxy-2-[(S)-1-[(S)-2-methyl-1-oxobutoxy]-4-methyl-3-pentenyl]-1,4-naphthalenedione
|
637472 |
Click to see
CCC(C)C(=O)OC(CC=C(C)C)C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O
|
372.40 |
unknown |
via CMAUP database |
Acetylalkannin
|
9967285 |
Click to see
CC(=CCC(C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O)OC(=O)C)C
|
330.30 |
unknown |
via CMAUP database |
Alkannin
|
72521 |
Click to see
CC(=CCC(C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O)O)C
|
288.29 |
unknown |
via CMAUP database |
Alkannin beta,beta-dimethylacrylate
|
442720 |
Click to see
CC(=CCC(C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O)OC(=O)C=C(C)C)C
|
370.40 |
unknown |
via CMAUP database |
Anhydroalkannin
|
101626182 |
Click to see
CC(=CC=CC1=CC(=O)C2=C(C=CC(=C2C1=O)O)O)C
|
270.28 |
unknown |
via CMAUP database |
beta-Acetoxyisovalerylshikonin
|
69295815 |
Click to see
CC(=CCC(C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O)OC(=O)CC(C)(C)OC(=O)C)C
|
430.40 |
unknown |
via CMAUP database |
beta-Hydroxyisovalerylshikonin
|
479502 |
Click to see
CC(=CCC(C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O)OC(=O)CC(C)(C)O)C
|
388.40 |
unknown |
via CMAUP database |
beta,beta-Dimethylacrylshikonin
|
479499 |
Click to see
CC(=CCC(C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O)OC(=O)C=C(C)C)C
|
370.40 |
unknown |
via CMAUP database |
Butanoic acid, 3-(acetyloxy)-3-methyl-, 1-(1,4-dihydro-5,8-dihydroxy-1,4-dioxo-2-naphthalenyl)-4-methyl-3-pentenyl ester, (S)-
|
155245 |
Click to see
CC(=CCC(C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O)OC(=O)CC(C)(C)OC(=O)C)C
|
430.40 |
unknown |
via CMAUP database |
Deoxyshikonin
|
98914 |
Click to see
CC(=CCCC1=CC(=O)C2=C(C=CC(=C2C1=O)O)O)C
|
272.29 |
unknown |
via CMAUP database |
Echinone
|
157629 |
Click to see
CC(=CCC(C1=CC(=C2C(=O)C=CC(=O)C2=C1OC)O)OC(=O)C)C
|
344.40 |
unknown |
via CMAUP database |
Isobutyryl Alkannin
|
5318520 |
Click to see
CC(C)C(=O)OC(CC=C(C)C)C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O
|
358.40 |
unknown |
via CMAUP database |
Isovalerylalkannin
|
5318685 |
Click to see
CC(C)CC(=O)OC(CC=C(C)C)C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O
|
372.40 |
unknown |
via CMAUP database |
Shikonin
|
479503 |
Click to see
CC(=CCC(C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O)O)C
|
288.29 |
unknown |
via CMAUP database |
Teracrylshikonin
|
15931504 |
Click to see
CC(=CCC(C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O)OC(=O)CC(=C(C)C)C)C
|
398.40 |
unknown |
via CMAUP database |
> Benzenoids / Phenols / Benzenediols / Hydroquinones
|
Ethyl 9-(2,5-dihydroxyphenyl)nonanoate
|
91544169 |
Click to see
CCOC(=O)CCCCCCCCC1=C(C=CC(=C1)O)O
|
294.40 |
unknown |
via CMAUP database |
> Lignans, neolignans and related compounds / Aryltetralin lignans
|
(2R)-2-[(1R,2S)-3-[(1R)-1-carboxylato-2-(3,4-dihydroxyphenyl)ethoxy]carbonyl-1-(3,4-dihydroxyphenyl)-6,7-dihydroxy-1,2-dihydronaphthalene-2-carbonyl]oxy-3-(3,4-dihydroxyphenyl)propanoate
|
5320234 |
Click to see
C1=CC(=C(C=C1CC(C(=O)[O-])OC(=O)C2C(C3=CC(=C(C=C3C=C2C(=O)OC(CC4=CC(=C(C=C4)O)O)C(=O)[O-])O)O)C5=CC(=C(C=C5)O)O)O)O
|
716.60 |
unknown |
via CMAUP database |
Rabdosiin
|
471121 |
Click to see
C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C2C(C3=CC(=C(C=C3C=C2C(=O)OC(CC4=CC(=C(C=C4)O)O)C(=O)O)O)O)C5=CC(=C(C=C5)O)O)O)O
|
718.60 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Hopanoids
|
Hopenone I
|
21603525 |
Click to see
CC(C)C1=C2CCC3(C(C2(CC1)C)CCC4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C
|
424.70 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Quinone and hydroquinone lipids / Prenylquinones / Ubiquinones
|
Arnebifuranone
|
6438590 |
Click to see
CC(=CCCC1=COC=C1)CC2=CC(=O)C(=C(C2=O)OC)OC
|
316.30 |
unknown |
via CMAUP database |
Isoarnebifuranone
|
6505036 |
Click to see
CC(=CCCC1=COC=C1)CC2=CC(=O)C(=C(C2=O)OC)OC
|
316.30 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
|
Tormentic acid
|
73193 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1(C)O)C)C(=O)O
|
488.70 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids / Ergosterols and derivatives
|
Ergosta-4,6,8(14),22-tetraen-3-one
|
6441416 |
Click to see
CC(C)C(C)C=CC(C)C1CCC2=C3C=CC4=CC(=O)CCC4(C3CCC12C)C
|
392.60 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
|
Stigmast-4-ene-3,6-dione
|
5490007 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC(=O)C4=CC(=O)CCC34C)C)C(C)C
|
426.70 |
unknown |
via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Ethers / Alkyl aryl ethers
|
Arnebinol
|
5281558 |
Click to see
CC1=CCC2=C(C=CC(=C2)OCC(=CCC1)C)O
|
244.33 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives
|
(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
|
54691413 |
Click to see
COC1=C(C=CC(=C1)C=CC(=O)O)[O-]
|
193.18 |
unknown |
via CMAUP database |
(R)-rosmarinate
|
25245604 |
Click to see
C1=CC(=C(C=C1CC(C(=O)[O-])OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O
|
359.30 |
unknown |
via CMAUP database |
Hexacosyl (E)-ferulate
|
5318033 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCCCCOC(=O)C=CC1=CC(=C(C=C1)O)OC
|
558.90 |
unknown |
via CMAUP database |
Octacosyl (E)-ferulate
|
5743442 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCCCCCCOC(=O)C=CC1=CC(=C(C=C1)O)OC
|
586.90 |
unknown |
via CMAUP database |
Octyl ferulate
|
15875260 |
Click to see
CCCCCCCCOC(=O)C=CC1=CC(=C(C=C1)O)OC
|
306.40 |
unknown |
via CMAUP database |
Tetracosyl ferulate
|
14238617 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCCOC(=O)C=CC1=CC(=C(C=C1)O)OC
|
530.80 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glucuronides / Flavonoid-7-O-glucuronides
|
Luteolin 7-glucuronide
|
5280601 |
Click to see
C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O)O
|
462.40 |
unknown |
https://doi.org/10.1515/ZNC-1986-11-1203 |
> Phenylpropanoids and polyketides / Macrolides and analogues
|
(R)-De-O-methyllasiodiplodin
|
14562694 |
Click to see
CC1CCCCCCCC2=C(C(=CC(=C2)O)O)C(=O)O1
|
278.34 |
unknown |
via CMAUP database |
de-O-methyllasiodiplodin
|
14562695 |
Click to see
CC1CCCCCCCC2=C(C(=CC(=C2)O)O)C(=O)O1
|
278.34 |
unknown |
via CMAUP database |