input word = C00030742

Metabolite InformationStructural formula
Name 2alpha,3beta-Dihydroxyolean-12-en-28-oic acid
Maslinic acid
Crategolic acid
Formula C30H48O4
Mw 472.35526002
CAS RN 4373-41-5
C_ID C00030742 ,
InChIKey MDZKJHQSJHYOHJ-YEBDSSMWNA-N
InChICode 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+/m1/s1
SMILES [C@@H]1([C@@H](C([C@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@]2(C(=CC1)[C@@H]1[C@@](CC2)(CCC(C1)(C)C)C(=O)O)C)C)C)(C)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeAnisomeles indica Ref.
PlantaeLabiataeCallicarpa arborea Ref.
PlantaeLabiataeCallicarpa macrophylla Ref.
PlantaeLabiataeHyptis brevipes Ref.
PlantaeLabiataeLeucas aspera Ref.
PlantaeLabiataeMeriandra benghalensis Ref.
PlantaeLabiataeOcimum spicatum Ref.
PlantaeLabiataeSalvia officinalis Ref.
PlantaeLamiaceaeColeus aromaticus Ref.
PlantaeLythraceaePunica granatum LINN. Ref.
PlantaeMalvaceaeDurio kutejensis Ref.
PlantaeMalvaceaeGrewia bilamellata Ref.
PlantaeMyricaceaeMyrica rubra Ref.
PlantaeMyrtaceaeEugenia sandwicensis Ref.
PlantaeMyrtaceaeSyzygium aromatica Ref.
PlantaeNothofagaceae/FagaceaeNothofagus pumilio Ref.
PlantaeOleaceaeOlea europaea Ref.
PlantaeRosaceaeChaenomeles sinensis KOEHNE Ref.
PlantaeTheaceae/Pentaphylacaceae/TernstroemiaceaeTernstroemia gymnanthera Ref.
PlantaeTrochodendraceae/TetracentraceaeTetracentron sinense Ref.
PlantaeUlmaceaeUlmus pumila L. Ref.
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OrganismGrewia bilamellata
ReferenceMa,J.Nat.Prod.,69,(2006),346