Chemical Composition and In Vitro and In Silico Biological Activities of Myrciaria tenella (DC.) O.Berg (Myrtaceae) Essential Oil from Brazil

Table 1

Chemical compounds identified in the species in the essential oil of Myrciaria tenella.

Myrciaria tenella
IRL	IRC	Yield (%)	0.74
		Chemical constituents	Area (%)
1335	1340	δ-Elemene	0.03
1345	1353	α-Cubebene	0.24
1373	1375	α-Ylangene	0.52
1374	1380	α-Copaene	2.02
1387	1389	β-Bourbonene	0.09
1390	1394	Sativene	0.07
1400	1400	β-Longipinene	0.07
1409	1414	α-Gurjunene	0.16
1417	1431	(E)-Caryophyllene	33.95
1430	1436	β-Copaene	2.57
1434	1438	γ-Elemene	0.4
1480	1441	α-Maaliene	0.1
1439	1445	Aromadendrene	2.23
1458	1448	allo-aromadendrene	0.37
1448	1451	cis-muurola-3,5-diene	0.15
1451	1456	trans-muurola-3,5-diene	0.44
1452	1460	α-Humulene	3.23
1464	1466	9-epi-(E)-caryophyllene	0.5
1471	1474	4,5-di-epi-aristolochene	0.03
1471	1478	Dauca-5,8-diene	0.67
1484	1482	Germacrene D	3.86
1483	1485	α-Amorphene	0.72
1489	1492	β-Selinene	1.92
1492	1496	cis-β-guaiene	0.69
1496	1500	Viridiflorene	4.49
1500	1505	α-Muurolene	1.61
1511	1513	δ-Amorphene	2.49
1513	1521	γ-Cadinene	3.31
1520	1524	7-epi-α-selinene	0.07
1522	1531	δ-Cadinene	7.4
1528	1532	Zonarene	0.38
1533	1538	trans-cadina-1,4-diene	0.62
1540	1542	Selina-4(15),7(11)-diene	0.4
1537	1543	α-Cadinene	0.69
1544	1549	α-Calacorene	1.67
1562	1558	epi-longipinanol	0.06
1559	1563	Germacrene B	0.06
1567	1565	Longipinanol	0.36
1564	1568	β-Calacorene	0.27
1566	1573	Maaliol	0.12
1571	1576	Caryolan-8-ol	0.08
1577	1584	Spathulenol	0.66
1582	1591	Caryophyllene oxide	4.74
1592	1598	Viridiflorol	1.33
1600	1608	Rosifoliol	0.33
1602	1610	Ledol	0.16
1608	1615	Humulene epoxide II	0.2
1618	1621	1,10-di-epi-cubenol	1.12
1629	1629	Eremoligenol	0.64
1627	1635	1-epi-cubenol	2.35
1645	1639	Cubenol	1.18
1639	1643	Caryophylla-4(12),8(13)-dien-5-β-ol	0.54
1640	1649	epi-α-muurolol	2.83
1644	1652	α-Muurolol	0.99
1652	1658	Himachalol	0.39
1652	1662	α-Cadinol	2.8
1685	1676	Germacra-4(15),5,10(14)-trien-1-α-ol	0.30
1700	1702	Eudesm-7(11)-en-4-ol	0.09
		Hydrocarbon sesquiterpenes	78.49
		Oxygenated sesquiterpenes	21.27
		Total	99.76

IRL: Adams literature retention index [19]; CRI: retention index calculated from a homologous series of n-alkanes (C8–C40) in a DB5-MS column; relative area (%) calculated based on peak areas.