input word = C00024262

Metabolite InformationStructural formula
Name Gravacridonediol glucoside
Formula C25H29NO10
Mw 503.17914616
CAS RN 59086-97-4
C_ID C00024262 ,
InChIKey JWQLKRFRUYIERF-NOUQHCNJNA-N
InChICode InChI=1S/C25H29NO10/c1-25(33,10-34-24-23(32)22(31)21(30)16(9-27)36-24)17-7-12-15(35-17)8-14(28)18-19(12)26(2)13-6-4-3-5-11(13)20(18)29/h3-6,8,16-17,21-24,27-28,30-33H,7,9-10H2,1-2H3/t16-,17+,21-,22+,23+,24-,25-/m1/s1
SMILES c1cccc2c1c(=O)c1c(n2C)c2c(cc1O)O[C@@H](C2)[C@@](CO[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@@H]1O)CO)(O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
PlantaeRutaceaeRuta graveolens Ref.
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