input word = C00010484

Metabolite InformationStructural formula
Name Arborside A
Formula C31H34O13
Mw 614.19994117
CAS RN 128450-78-2
C_ID C00010484 ,
InChIKey MLCOOYQKNSDMRD-HZCGQHQONA-N
InChICode InChI=1S/C31H34O13/c1-15-20-21(18(29(38)39-2)14-40-30(20)44-31-24(35)23(34)22(33)19(13-32)41-31)26(43-28(37)17-11-7-4-8-12-17)25(15)42-27(36)16-9-5-3-6-10-16/h3-12,14-15,19-26,30-35H,13H2,1-2H3/t15-,19-,20-,21-,22-,23-,24+,25-,26+,30+,31+/m1/s1
SMILES [C@H]12[C@H]([C@@H](OC=C1C(=O)OC)O[C@@H]1O[C@@H]([C@H]([C@H]([C@@H]1O)O)O)CO)[C@H]([C@H]([C@H]2OC(=O)c1ccccc1)OC(=O)c1ccccc1)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOleaceaeNyctanthes arbor-tristis Ref.
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OrganismNyctanthes arbor-tristis
ReferenceStivastava,J.Nat.Prod.,53,(1990),303