epi-maslinic acid (Q27135304)

inferred from SMILES

mass

472.35526±0 dalton

1 reference

3-epimaslinic acid (English)

(4aS,6aR,6aS,6bR,8aS,10S,11R,12aR,14bS)-10,11-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

7 October 2016

stereoisomer of

2 references

(4aS,6aR,6aS,6bR,8aR,10R,11R,12aR,14bR)-10,11-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

inferred from InChI

2 references

(4aS,6aR,6aS,6bR,8aR,10S,11R,12aR,14bR)-10,11-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

inferred from InChI

2 references

2 references

(4aS,6aS,6aS,6bR,8aR,10R,11R,12aR,14bS)-10,11-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

1 reference

1 reference

(4aS,6aS,6bR,8aR,10R,11R,12aR,12bR,14bS)-10,11-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid

inferred from InChI

1 reference

1 reference

C₃₀H₄₈O₄

1 reference

3-epimaslinic acid (English)

7 October 2016

canonical SMILES

CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1)C)C(=O)O)C

1 reference

3-epimaslinic acid (English)

7 October 2016

isomeric SMILES

C[C@@]12CC[C@@H]3[C@@]([C@H]1CC=C4[C@]2(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)(C[C@H]([C@H](C3(C)C)O)O)C

1 reference

Pentacyclic triterpenoids from Prunella vulgaris

3-epimaslinic acid (English)

7 October 2016

3 references

Triterpenoids from Prunella vulgaris

Triterpenoids from Prunella vulgaris

Salvia grandiflora

1 reference

Triterpene acids from Salvia and Teucrium species

Perilla frutescens var. frutescens

1 reference

Cytotoxic activity of Perilla frutescens var. japonica leaf extract is due to high concentrations of oleanolic and ursolic acids

Ocimum spicatum

1 reference

Triterpenes and Sterols From Ocimum spicatum

Prunus africana

1 reference

New constituents of Prunus africana bark extract

Schnabelia tetradonta

1 reference

Chemical Constituents from the Roots of Schnabelia tetradonta.

Scutellaria columnae

1 reference

Secondary metabolites from a callus culture of Scutellaria columnae

Thomandersia laurifolia

1 reference

Thomandertriol, a Triterpenoid from the Twigs of Thomandersia laurifolia

Vitex altissima

2 references

Flavonoids, triterpenoids and a lignan from Vitex altissima

Flavonoids, triterpenoids and a lignan from Vitex altissima

Isodon japonicus

1 reference

Biosynthesis of the terpenes maslinic acid and 3-epimaslinic acid in tissue cultures of Isodon japonicus hara

Akebia trifoliata

1 reference

Triterpenes and triterpene saponins from the stems of Akebia trifoliata.

Centella asiatica

1 reference

Antiproliferative constituents from Umbelliferae plants VII. Active triterpenes and rosmarinic acid from Centella asiatica

Holoptelea integrifolia

1 reference

2Alpha,3alpha-dihydroxyolean-12-en-28-oic acid from Holoptelea Integrifolia heartwood

Perilla frutescens

1 reference

Triterpene acids from the leaves of Perilla frutescens and their anti-inflammatory and antitumor-promoting effects

Salvia virgata

1 reference

Terpenoids from Salvia willeana and S. Virgata

Salvia willeana

1 reference

Terpenoids from Salvia willeana and S. Virgata

Vitex agnus-castus

2 references

Phytoconstituents from Vitex agnus-castus fruits

A new diterpenoid glucoside and two new diterpenoids from the fruit of Vitex agnus-castus

Vitex negundo

1 reference

Anti-inflammatory ursane- and oleanane-type triterpenoids from Vitex negundo var. cannabifolia

Salvia officinalis

1 reference

Bestandteile von Salvia officinalis

Salvia fulgens

1 reference

Triterpene acids from Salvia and Teucrium species

Identifiers

InChI

InChI=1S/C30H48O4/c1-25(2)12-14-30(24(33)34)15-13-28(6)18(19(30)16-25)8-9-22-27(5)17-20(31)23(32)26(3,4)21(27)10-11-29(22,28)7/h8,19-23,31-32H,9-17H2,1-7H3,(H,33,34)/t19-,20+,21-,22+,23+,27-,28+,29+,30-/m0/s1

1 reference

3-epimaslinic acid (English)

MDZKJHQSJHYOHJ-HFYZCPLSSA-N

7 October 2016

InChIKey

2 references

3-epimaslinic acid (English)

7 October 2016

ChEBI release 2020-09-01

CAS Registry Number

26563-68-8

1 reference

CAS (formerly Chemical Abstracts Service)

25 January 2022

1 reference

(2alpha,3alpha)-2,3-Dihydroxyolean-12-en-28-oic acid (English)

7 October 2016

2 references

3-epimaslinic acid (English)

matched by identifier from

7 October 2016

InChIKey

MDZKJHQSJHYOHJ-HFYZCPLSSA-N

Reaxys registry number

2955659

1 reference

epi-maslinic acid (English)

7 October 2016

ChEBI ID

66683

mapping relation type

2 references

epi-maslinic acid (English)

matched by identifier from

7 October 2016

International Chemical Identifier

InChI

InChI=1S/C30H48O4/c1-25(2)12-14-30(24(33)34)15-13-28(6)18(19(30)16-25)8-9-22-27(5)17-20(31)23(32)26(3,4)21(27)10-11-29(22,28)7/h8,19-23,31-32H,9-17H2,1-7H3,(H,33,34)/t19-,20+,21-,22+,23+,27-,28+,29+,30-/m0/s1

1 reference

matched by identifier from

CHEMBL383749 (English)

7 October 2016

1 reference

1 reference

InChIKey

MDZKJHQSJHYOHJ-HFYZCPLSSA-N

1 reference

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download