input word = C00047703

Metabolite InformationStructural formula
Name Alangilignoside C
(+)-5,5'-Dimethoxy-9-O-beta-D-glucopyranosyl lariciresinol
(+)-Alangilignoside C
Formula C28H38O13
Mw 582.2312413
CAS RN 191481-00-2
C_ID C00047703 ,
InChIKey HIFLTWHGASFARX-SSFLWZTINA-N
InChICode InChI=1S/C28H38O13/c1-35-17-6-13(7-18(36-2)22(17)30)5-15-11-39-27(14-8-19(37-3)23(31)20(9-14)38-4)16(15)12-40-28-26(34)25(33)24(32)21(10-29)41-28/h6-9,15-16,21,24-34H,5,10-12H2,1-4H3/t15-,16-,21+,24+,25-,26+,27+,28+/m0/s1
SMILES c1c(cc(c(c1OC)O)OC)[C@H]1OC[C@@H]([C@@H]1CO[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)Cc1cc(c(c(c1)OC)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCapparaceaeCapparis flavicans Ref.
--Baphicacanthus cusia Ref.
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OrganismBaphicacanthus cusia
ReferenceTanaka, et al., Chem Pharm Bull, 52, (2004), 1242.