KNApSAcK Metabolite Information

input word = C00003740

Metabolite Information

Structural formula

Name

Betulin

Formula

C30H50O2

442.38108084

CAS RN

473-98-3

C_ID

C00003740 ,

InChIKey

FVWJYYTZTCVBKE-YYHFAXQKNA-N

InChICode

InChI=1S/C30H50O2/c1-19(2)20-10-15-30(18-31)17-16-28(6)21(25(20)30)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h20-25,31-32H,1,8-18H2,2-7H3/t20-,21+,22-,23+,24-,25+,27-,28+,29+,30+/m0/s1

SMILES

C=C(C)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12

Start Substs in Alk. Biosynthesis (Prediction)

Organism

Kingdom	Family	Species	Reference
Plantae	Acanthaceae	Hypoestes purpurea	Ref.
Plantae	Acanthaceae	Phlogacanthus curviflorus	Ref.
Plantae	Acanthaceae	Strobilanthes cusia	Ref.
Plantae	Acanthaceae	Strobilanthes formosanus	Ref.
Plantae	Adoxaceae	Sambucus williamsii	Ref.
Plantae	Apocynaceae	Nerium oleander	Ref.
Plantae	Apocynaceae	Thevetia peruviana	Ref.
Plantae	Asteraceae	Cichorium intybus	Ref.
Plantae	Asteraceae	Saussurea lappa	Ref.
Plantae	Betulaceae	Alnus oregana	Ref.
Plantae	Betulaceae	Betula alba	Ref.
Plantae	Betulaceae	Betula platyphylla	Ref.
Plantae	Betulaceae	Corylus avellana	Ref.
Plantae	Boraginaceae	Arnebia hispidissima	Ref.
Plantae	Boraginaceae	Arnebia nobilis	Ref.
Plantae	Campanulaceae/Lobeliaceae	Platycodon grandiflorum	Ref.
Plantae	Celastraceae	Maytenus chiapensis	Ref.
Plantae	Celastraceae	Maytenus cuzcoina	Ref.
Plantae	Combretaceae	Terminalia brasiliensis	Ref.
Plantae	Ebenaceae	Diospyros abyssinica	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 chloroxylon	Ref.
Plantae	Ebenaceae	Diospyros cinnabarina	Ref.
Plantae	Ebenaceae	Diospyros consolatae	Ref.
Plantae	Ebenaceae	Diospyros crassiflora	Ref.
Plantae	Ebenaceae	Diospyros curranii	Ref.
Plantae	Ebenaceae	Diospyros dendo	Ref.
Plantae	Ebenaceae	Diospyros discolor	Ref.
Plantae	Ebenaceae	Diospyros ebenum	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 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 leucomelas	Ref.
Plantae	Ebenaceae	Diospyros longiflora	Ref.
Plantae	Ebenaceae	Diospyros lotus	Ref.
Plantae	Ebenaceae	Diospyros maingayi	Ref.
Plantae	Ebenaceae	Diospyros malanonilau	Ref.
Plantae	Ebenaceae	Diospyros mannii	Ref.
Plantae	Ebenaceae	Diospyros maritima	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 obliquifolia	Ref.
Plantae	Ebenaceae	Diospyros peregrina	Ref.
Plantae	Ebenaceae	Diospyros pseudo-malabarica	Ref.
Plantae	Ebenaceae	Diospyros quaesita	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 verrucosa	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	Erica arborea L.	Ref.
Plantae	Euphorbiaceae	Euphorbia lathyris	Ref.
Plantae	Euphorbiaceae	Euphorbia paralias	Ref.
Plantae	Fabaceae	Acacia mellifera	Ref.
Plantae	Fabaceae	Cassia siamea Lamk.	Ref.
Plantae	Fabaceae	Dalbergia sericea	Ref.
Plantae	Fabaceae	Lespedeza bicolor	Ref.
Plantae	Fabaceae	Pterocarpus santalinus	Ref.
Plantae	Fabaceae	Vicia faba	Ref.
Plantae	Juglandaceae	Juglans regia	Ref.
Plantae	Labiatae	Origanum compactum	Ref.
Plantae	Labiatae	Rosmarinus officinalis L.	Ref.
Plantae	Labiatae	Salvia officinalis	Ref.
Plantae	Lardizabalaceae	Stauntonia obovatifoliola Hayata subsp.intermedia	Ref.
Plantae	Lythraceae	Lawsonia alba	Ref.
Plantae	Malpighiaceae	Byrsonima microphylla	Ref.
Plantae	Myrtaceae	Melaleuca ericifolia	Ref.
Plantae	Myrtaceae	Syzygium formosanum	Ref.
Plantae	Oleaceae	Jasminum lanceolarium	Ref.
Plantae	Oleaceae	Phillyrea latifolia L.	Ref.
Plantae	Pelliaceae	Pellia epiphylla	Ref.
Plantae	Phyllanthaceae	Phyllanthus flexuosus	Ref.
Plantae	Phyllanthaceae	Phyllanthus urinaria	Ref.
Plantae	Rhamnaceae	Ziziphus jujuba	Ref.
Plantae	Rhamnaceae	Zizyphus vulgaris var.spinosus	Ref.
Plantae	Rhizophoraceae	Ceriops tagal	Ref.
Plantae	Rosaceae	Chaenomeles sinensis KOEHNE	Ref.
Plantae	Rubiaceae	Coussarea paniculata	Ref.
Plantae	Sapindaceae	Schleichera oleosa	Ref.
Plantae	Trochodendraceae/Tetracentraceae	Tetracentron sinense	Ref.
Plantae	Ulmaceae	Celtis philippinensis	Ref.
Plantae	Valerianaceae/Linnaeaceae/Dipsacaceae/Diervillaceae	Valeriana laxiflora	Ref.
-	-	Asteracantha longifolia	Ref.
-	-	Befaria glutinosa	Ref.

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