input word = C00041698

Metabolite InformationStructural formula
Name Nicandrose B
(+)-Nicandrose B
Formula C32H54O15
Mw 678.34627106
CAS RN 915234-87-6
C_ID C00041698 ,
InChIKey BOPMBSSYOZCUCZ-JWSGUQOLNA-N
InChICode InChI=1S/C32H54O15/c1-7-8-9-10-11-12-13-14-23(36)43-27-26(44-29(39)18(2)3)24(37)21(15-33)42-31(27)47-32(17-41-20(6)35)28(45-30(40)19(4)5)25(38)22(16-34)46-32/h18-19,21-22,24-28,31,33-34,37-38H,7-17H2,1-6H3/t21-,22-,24-,25-,26+,27-,28+,31-,32+/m1/s1
SMILES [C@@H]1([C@@H]([C@H]([C@H](O[C@@H]1CO)O[C@@]1(O[C@@H]([C@H]([C@@H]1OC(=O)C(C)C)O)CO)COC(=O)C)OC(=O)CCCCCCCCC)OC(=O)C(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaePhysalis nicandroides var.attenuata Ref.
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OrganismPhysalis nicandroides var.attenuata
ReferenceMaldonado,J.Nat.Prod.,69,(2006),1511