input word = C00043439

Metabolite InformationStructural formula
Name Daphcalycinosidine C
Formula C38H49NO12
Mw 711.32547604
CAS RN 752252-75-8
C_ID C00043439 ,
InChIKey BGFSQHCTVLDZEX-LTBFGZLDNA-N
InChICode InChI=1S/C38H49NO12/c1-16-11-39-12-19-6-3-17-4-8-21-23(10-38(28(17)21)32(44)22(16)9-26(39)37(19,38)2)34(47)48-15-25-29(41)30(42)31(43)36(50-25)51-35-27-18(13-40)5-7-20(27)24(14-49-35)33(45)46/h5,14,16,19-23,25-27,29-31,35-36,40-43H,3-4,6-13,15H2,1-2H3,(H,45,46)/t16-,19-,20-,21-,22-,23-,25-,26-,27-,29-,30+,31-,35+,36+,37-,38+/m1/s1
SMILES [C@]123[C@@]4([C@H](CCC5=C1[C@@H]([C@@H](C3)C(=O)OC[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)O[C@H]1[C@H]3[C@@H](C(=CO1)C(=O)O)CC=C3CO)CC5)CN1[C@@H]4C[C@@H](C2=O)[C@@H](C1)C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Cholesterol
Organism
Kingdom Family Species Reference
PlantaeDaphniphyllaceaeDaphniphyllum calycinum Ref.
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