input word = C00041421

Metabolite InformationStructural formula
Name Capisterone B
(+)-Capisterone B
Formula C30H48O7S
Mw 552.31207462
CAS RN 760202-17-3
C_ID C00041421 ,
InChIKey CCRYNKGKKAVQTA-PEWVWQDMNA-N
InChICode InChI=1S/C30H48O7S/c1-19(2)14-21(32)15-20(3)22-8-10-27(5)23-6-7-24-28(17-31,18-37-38(34,35)36)25(33)9-11-29(24)16-30(23,29)13-12-26(22,27)4/h19-20,22-24,31H,6-18H2,1-5H3,(H,34,35,36)/t20-,22-,23-,24+,26?,27+,28+,29-,30+/m1/s1
SMILES C1C(=O)[C@]([C@H]2[C@]3(C1)[C@]1([C@H](CC2)[C@]2([C@](CC1)([C@H](CC2)[C@@H](CC(=O)CC(C)C)C)C)C)C3)(COS(=O)(=O)O)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeUdoteaceaePenicillus capitatus Ref.
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OrganismPenicillus capitatus
ReferenceLi,J.Nat.Prod.,69,(2006),542