input word = C00005780

Metabolite InformationStructural formula
Name Syringetin 3-O-rutinoside
Syringetin 3-rutinoside
Formula C29H34O17
Mw 654.17959966
CAS RN 53430-50-5
C_ID C00005780 ,
InChIKey BWDMLCWSGGUHGK-JTYKZUITNA-N
InChICode InChI=1S/C29H34O17/c1-9-18(32)22(36)24(38)28(43-9)42-8-16-20(34)23(37)25(39)29(45-16)46-27-21(35)17-12(31)6-11(30)7-13(17)44-26(27)10-4-14(40-2)19(33)15(5-10)41-3/h4-7,9,16,18,20,22-25,28-34,36-39H,8H2,1-3H3/t9-,16+,18-,20-,22-,23+,24-,25+,28+,29-/m0/s1
SMILES COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2OC(CO[C@@H]3OC(C)[C@H](O)[C@H](O)C3O)[C@@H](O)C(O)C2O)cc(OC)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeLathyrus aphaca Ref.
PlantaeLimnanthaceaeLimnanthes douglasii Ref.
PlantaePinaceaeAbies amabilis Ref.
PlantaePinaceaeLarix decidua Ref.
PlantaePinaceaeLarix sibirica Ref.
PlantaePinaceaePicea abies Ref.
PlantaeZygophyllaceaeLarrea spp. Ref.
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OrganismPicea abies
Referencehttps://doi.org/10.1002/(SICI)1099-1565(199601)7:1<42::AID-PCA282>3.0.CO

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