KNApSAcK Metabolite Information

input word = C00003749

Metabolite Information

Structural formula

Name

Lupeol
Lupenol
(+)-Lupenol

Formula

C30H50O

426.38616622

CAS RN

545-47-1

C_ID

C00003749 ,

InChIKey

MQYXUWHLBZFQQO-ZAEXXZHRNA-N

InChICode

InChI=1S/C30H50O/c1-19(2)20-11-14-27(5)17-18-29(7)21(25(20)27)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h20-25,31H,1,9-18H2,2-8H3/t20-,21+,22-,23+,24-,25+,27+,28-,29+,30+/m0/s1

SMILES

C1[C@@H](C([C@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@]2([C@H](CC1)[C@@H]1[C@](CC2)(C)CC[C@H]1C(=C)C)C)C)C)(C)C)O

Start Substs in Alk. Biosynthesis (Prediction)

Organism

Kingdom	Family	Species	Reference
Animalia	Bombycidae	Bombyx mori	Ref.
Fungi	Coprinaceae	Coprinus atramentarius	Ref.
Plantae	Acanthaceae	Phlogacanthus curviflorus	Ref.
Plantae	Acanthaceae	Rhinacanthus nasutus	Ref.
Plantae	Acanthaceae	Strobilanthes cusia BREMEK	Ref.
Plantae	Apocynaceae	Alstonia boonei	Ref.
Plantae	Apocynaceae	Hemidesmus indicus	Ref.
Plantae	Apocynaceae	Periploca aphylla	Ref.
Plantae	Apocynaceae	Thevetia peruviana	Ref.
Plantae	Aquifoliaceae	Ilex cornuta	Ref.
Plantae	Aquifoliaceae	Ilex latifolia	Ref.
Plantae	Asteraceae	Brachylaena ramiflora var. ramiflora	Ref.
Plantae	Asteraceae	Centipeda minima	Ref.
Plantae	Asteraceae	Chuquiraga ulicina ssp. ulicina	Ref.
Plantae	Asteraceae	Cichorium intybus	Ref.
Plantae	Asteraceae	Elephantopus scaber	Ref.
Plantae	Asteraceae	Eupatorium macrocephalum Lee.	Ref.
Plantae	Asteraceae	Launaea arborescens	Ref.
Plantae	Asteraceae	Liatris laevigata	Ref.
Plantae	Asteraceae	Ligularia dentata Hara	Ref.
Plantae	Asteraceae	Ligularia odontomanes	Ref.
Plantae	Asteraceae	Ligularia sagitta	Ref.
Plantae	Asteraceae	Petasites formosanus	Ref.
Plantae	Asteraceae	Piptocarpha paradoxa	Ref.
Plantae	Asteraceae	Saussurea lappa Clarke.	Ref.
Plantae	Asteraceae	Scorzonera cretica	Ref.
Plantae	Asteraceae	Senecio chionophilus	Ref.
Plantae	Asteraceae	Sonchus arvensis	Ref.
Plantae	Asteraceae	Taraxacum officinale	Ref.
Plantae	Asteraceae	Vernonia erdverbengii	Ref.
Plantae	Betulaceae	Betula platyphylla	Ref.
Plantae	Burseraceae	Bursera graveolens	Ref.
Plantae	Burseraceae	Commiphora dalzielii	Ref.
Plantae	Cannabaceae	Humulus lupulus	Ref.
Plantae	Celastraceae	Maytenus cuzcoina	Ref.
Plantae	Clusiaceae-Guttiferae	Allanblackia monticola Staner L.C	Ref.
Plantae	Clusiaceae/Clusiaceae-Guttiferae	Garcinia bancana MIQ	Ref.
Plantae	Clusiaceae/Clusiaceae-Guttiferae	Garcinia vilersiana	Ref.
Plantae	Combretaceae	Pteleopsis hylodendron	Ref.
Plantae	Combretaceae	Terminalia superba	Ref.
Plantae	Cornaceae/Aucubaceae/Garryaceae/Helwingiaceae	Cornus officinalis	Ref.
Plantae	Crassulaceae	Kalanchoe daigremontiana	Ref.
Plantae	Ebenaceae	Diospyros abyssinica	Ref.
Plantae	Ebenaceae	Diospyros acuta	Ref.
Plantae	Ebenaceae	Diospyros argentea	Ref.
Plantae	Ebenaceae	Diospyros bipindensis	Ref.
Plantae	Ebenaceae	Diospyros buxifolia	Ref.
Plantae	Ebenaceae	Diospyros canaliculata	Ref.
Plantae	Ebenaceae	Diospyros candalleana	Ref.
Plantae	Ebenaceae	Diospyros castanea	Ref.
Plantae	Ebenaceae	Diospyros cauliflora	Ref.
Plantae	Ebenaceae	Diospyros chevalieri	Ref.
Plantae	Ebenaceae	Diospyros cinnabarina	Ref.
Plantae	Ebenaceae	Diospyros consolatae	Ref.
Plantae	Ebenaceae	Diospyros cordifolia	Ref.
Plantae	Ebenaceae	Diospyros cornii	Ref.
Plantae	Ebenaceae	Diospyros crassiflora	Ref.
Plantae	Ebenaceae	Diospyros curranii	Ref.
Plantae	Ebenaceae	Diospyros dendo	Ref.
Plantae	Ebenaceae	Diospyros diepenhorstii	Ref.
Plantae	Ebenaceae	Diospyros discolor	Ref.
Plantae	Ebenaceae	Diospyros ebenum	Ref.
Plantae	Ebenaceae	Diospyros ehretioides	Ref.
Plantae	Ebenaceae	Diospyros elliptifolia	Ref.
Plantae	Ebenaceae	Diospyros embryopteris	Ref.
Plantae	Ebenaceae	Diospyros eriantha	Ref.
Plantae	Ebenaceae	Diospyros evena	Ref.
Plantae	Ebenaceae	Diospyros exsculpta	Ref.
Plantae	Ebenaceae	Diospyros fragrans	Ref.
Plantae	Ebenaceae	Diospyros gabunensis	Ref.
Plantae	Ebenaceae	Diospyros gracilescens	Ref.
Plantae	Ebenaceae	Diospyros greeniway	Ref.
Plantae	Ebenaceae	Diospyros guianensis	Ref.
Plantae	Ebenaceae	Diospyros hirsuta	Ref.
Plantae	Ebenaceae	Diospyros hoyleana	Ref.
Plantae	Ebenaceae	Diospyros ismailii	Ref.
Plantae	Ebenaceae	Diospyros iturensis	Ref.
Plantae	Ebenaceae	Diospyros kaki	Ref.
Plantae	Ebenaceae	Diospyros kaki var.sylvestris	Ref.
Plantae	Ebenaceae	Diospyros kamerunensis	Ref.
Plantae	Ebenaceae	Diospyros longiflora	Ref.
Plantae	Ebenaceae	Diospyros lotus	Ref.
Plantae	Ebenaceae	Diospyros mafiensis	Ref.
Plantae	Ebenaceae	Diospyros maingayi	Ref.
Plantae	Ebenaceae	Diospyros mannii	Ref.
Plantae	Ebenaceae	Diospyros maritima BLUME	Ref.
Plantae	Ebenaceae	Diospyros melanoxylon	Ref.
Plantae	Ebenaceae	Diospyros mespiliformis	Ref.
Plantae	Ebenaceae	Diospyros monobuttensis	Ref.
Plantae	Ebenaceae	Diospyros montana	Ref.
Plantae	Ebenaceae	Diospyros moonii	Ref.
Plantae	Ebenaceae	Diospyros morrisiana	Ref.
Plantae	Ebenaceae	Diospyros natalensis	Ref.
Plantae	Ebenaceae	Diospyros obliquifolia	Ref.
Plantae	Ebenaceae	Diospyros oppositifolia	Ref.
Plantae	Ebenaceae	Diospyros peregrina	Ref.
Plantae	Ebenaceae	Diospyros pseudo-malabarica	Ref.
Plantae	Ebenaceae	Diospyros quaesita	Ref.
Plantae	Ebenaceae	Diospyros rheophytica	Ref.
Plantae	Ebenaceae	Diospyros rhodocalyx	Ref.
Plantae	Ebenaceae	Diospyros sanza-minika	Ref.
Plantae	Ebenaceae	Diospyros siamang	Ref.
Plantae	Ebenaceae	Diospyros siamensis	Ref.
Plantae	Ebenaceae	Diospyros siderophylla	Ref.
Plantae	Ebenaceae	Diospyros singaporensis	Ref.
Plantae	Ebenaceae	Diospyros spinescens	Ref.
Plantae	Ebenaceae	Diospyros sumatrana	Ref.
Plantae	Ebenaceae	Diospyros sylvatica	Ref.
Plantae	Ebenaceae	Diospyros thwaitesii	Ref.
Plantae	Ebenaceae	Diospyros tomentosa	Ref.
Plantae	Ebenaceae	Diospyros toposia	Ref.
Plantae	Ebenaceae	Diospyros virginiana	Ref.
Plantae	Ebenaceae	Diospyros walkeri	Ref.
Plantae	Ebenaceae	Diospyros wallichii	Ref.
Plantae	Ebenaceae	Diospyros zenkeri	Ref.
Plantae	Ebenaceae	Euclea divinorum	Ref.
Plantae	Ebenaceae	Euclea natalensis	Ref.
Plantae	Ericaceae	Enkianthus cernuus	Ref.
Plantae	Ericaceae	Epigaea asiatica	Ref.
Plantae	Ericaceae	Erica arborea L.	Ref.
Plantae	Ericaceae	Leucothoe grayana Max.	Ref.
Plantae	Ericaceae	Pieris japonica D.Don.	Ref.
Plantae	Euphorbiaceae	Croton zambesicus	Ref.
Plantae	Euphorbiaceae	Euphorbia larica	Ref.
Plantae	Euphorbiaceae	Euphorbia portlandica	Ref.
Plantae	Euphorbiaceae	Euphorbia supina Rafin	Ref.
Plantae	Euphorbiaceae	Euphorbia tanquahuete	Ref.
Plantae	Euphorbiaceae	Pedilanthus tithymaloides	Ref.
Plantae	Euphorbiaceae	Ricinus communis	Ref.
Plantae	Fabaceae	Acacia mellifera	Ref.
Plantae	Fabaceae	Acacia trineura	Ref.
Plantae	Fabaceae	Anadenanthera colubrine	Ref.
Plantae	Fabaceae	Caesalpinia decapetala	Ref.
Plantae	Fabaceae	Caesalpinia pulcherrima	Ref.
Plantae	Fabaceae	Cassia siamea Lamk.	Ref.
Plantae	Fabaceae	Cassia speciosa	Ref.
Plantae	Fabaceae	Crotalaria assamica	Ref.
Plantae	Fabaceae	Crotalaria pallida	Ref.
Plantae	Fabaceae	Deguelia hatschbachii	Ref.
Plantae	Fabaceae	Derris oblonga	Ref.
Plantae	Fabaceae	Entada scandens	Ref.
Plantae	Fabaceae	Eysenhardtia platycarpa	Ref.
Plantae	Fabaceae	Glycyrrhiza glabra	Ref.
Plantae	Fabaceae	Lotus japonicus	Ref.
Plantae	Fabaceae	Lupinus albus	Ref.
Plantae	Fabaceae	Lupinus luteus	Ref.
Plantae	Fabaceae	Piptadenia macrocarpa	Ref.
Plantae	Fabaceae	Pongamia pinnata	Ref.
Plantae	Fabaceae	Pterocarpus santalinus	Ref.
Plantae	Fabaceae	Sophora subprostrata	Ref.
Plantae	Fabaceae	Sophora substrata	Ref.
Plantae	Fabaceae	Tephrosia purpurea	Ref.
Plantae	Fagaceae	Quercus myrsenaefolia	Ref.
Plantae	Fagaceae	Quercus stenophylla Makino.	Ref.
Plantae	Gentianaceae	Gentiana lutea	Ref.
Plantae	Gentianaceae	Gentiana scabra	Ref.
Plantae	Hypericaceae	Harungana madagascariensis	Ref.
Plantae	Icacinaceae	Gonocaryum calleryanum	Ref.
Plantae	Labiatae	Marsypianthes chamaedrys	Ref.
Plantae	Labiatae	Salvia officinalis	Ref.
Plantae	Labiatae	Sideritis argosphacelus var. spicata	Ref.
Plantae	Labiatae	Sideritis candicans var.eriocephala	Ref.
Plantae	Lardizabalaceae	Stauntonia hexahylla	Ref.
Plantae	Lauraceae	Beilschmiedia erythrophloia	Ref.
Plantae	Lauraceae	Neolitsea konishii	Ref.
Plantae	Lauraceae	Neolitsea parvigemma	Ref.
Plantae	Longaniaceae	Strychnos potatorum	Ref.
Plantae	Loranthaceae	Loranthus parasiticus	Ref.
Plantae	Malpighiaceae	Byrsonima microphylla	Ref.
Plantae	Malvaceae	Adansonia digitata	Ref.
Plantae	Malvaceae	Eriolaena hookeriana	Ref.
Plantae	Meliaceae	Aglaia forbesii	Ref.
Plantae	Meliaceae	Azadirachta indica	Ref.
Plantae	Meliaceae	Dysoxylum malabaricum	Ref.
Plantae	Melianthaceae	Bersama swinyi	Ref.
Plantae	Moraceae	Dorstenia angusticornis	Ref.
Plantae	Moraceae	Ficus carica	Ref.
Plantae	Moraceae	Ficus microcarpa	Ref.
Plantae	Moraceae	Ficus rasemosa	Ref.
Plantae	Moraceae	Morus alba	Ref.
Plantae	Myricaceae	Myrica rubra	Ref.
Plantae	Myrtaceae	Rhodomyrtus tomentosa	Ref.
Plantae	Myrtaceae	Syzygium formosanum	Ref.
Plantae	Oleaceae	Nyctanthes arbor-tristis Linn.	Ref.
Plantae	Oleaceae	Olea europaea	Ref.
Plantae	Oleaceae	Phillyrea latifolia L.	Ref.
Plantae	Phyllanthaceae	Glochidion eriocarpum	Ref.
Plantae	Phyllanthaceae	Glochidion puberum	Ref.
Plantae	Phyllanthaceae	Phyllanthus emblica	Ref.
Plantae	Phyllanthaceae	Phyllanthus flexuosus	Ref.
Plantae	Plantaginaceae	Scoparia dulcis L.	Ref.
Plantae	Plantaginaceae	Stemodia foliosa	Ref.
Plantae	Polygonaceae	Coccoloba excoriata	Ref.
Plantae	Putranjivaceae	Drypetes tessmanniana	Ref.
Plantae	Rhamnaceae	Alphitonia petriei Braid et White.	Ref.
Plantae	Rhamnaceae	Ventilago leiocarpa	Ref.
Plantae	Rhizophoraceae	Bruguiera gymnorrhiza	Ref.
Plantae	Rhizophoraceae	Bruguiera parviflora	Ref.
Plantae	Rhizophoraceae	Ceriops tagal	Ref.
Plantae	Rubiaceae	Coussarea paniculata	Ref.
Plantae	Rubiaceae	Lasianthus gardneri	Ref.
Plantae	Rutaceae	Aegle marmelos	Ref.
Plantae	Rutaceae	Esenbeckia yaxhoob Lundell	Ref.
Plantae	Rutaceae	Fagara heitzii	Ref.
Plantae	Rutaceae	Fagara tessmannii Engl.	Ref.
Plantae	Rutaceae	Flindersia laevicarpa C.T.White et Francis.	Ref.
Plantae	Rutaceae	Luvunga sarmentosa (Bl.) Kurz.	Ref.
Plantae	Rutaceae	Oricia gabonensis	Ref.
Plantae	Rutaceae	Oricia suaveolens	Ref.
Plantae	Rutaceae	Vepris punctata	Ref.
Plantae	Rutaceae	Zanthoxylum armatum	Ref.
Plantae	Rutaceae	Zanthoxylum culantrillo	Ref.
Plantae	Rutaceae	Zanthoxylum dipetalum	Ref.
Plantae	Salicaceae	Populus tremula L.	Ref.
Plantae	Santalaceae	Viscum coloratum	Ref.
Plantae	Sapindaceae	Schleichera oleosa	Ref.
Plantae	Solanaceae	Lycium chinense	Ref.
Plantae	Stilbaceae	Nuxia sphaerocephala	Ref.
Plantae	Trochodendraceae/Tetracentraceae	Tetracentron sinense	Ref.
Plantae	Verbenaceae	Verbena officinalis L.	Ref.
-	-	Aegopordon berarioides	Ref.
-	-	Asteracantha longifolia	Ref.
-	-	Baphicacanthus cusia	Ref.
-	-	Befaria glutinosa	Ref.
-	-	Crataeva benthami	Ref.
-	-	Crotone hieronymi	Ref.
-	-	Hypestes purpurea	Ref.
-	-	Laurencia dendroidea	Ref.
-	-	Moghania macrophylla	Ref.
-	-	Tevenotica persica	Ref.
-	-	Zizphus cambodiana	Ref.

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Organism	Diospyros rheophytica
Reference	Mallavadhani,Phytochem.,49,(1998),901