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20,21-Diprenylterpendole J

MNXM146902 is deprecated and here replaced by MNXM1100346
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM1100346

	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	0

formula

C₄₂H₅₉NO₅

charge

mass

657.43932

reference

keggC:C20594

InChIKey

UGMIZDAXWBVEKZ-VBESAKQLSA-N

InChI

InChI=1S/C42H59NO5/c1-24(2)11-13-27-14-16-31-33(29(27)15-12-25(3)4)30-23-28-17-21-41(45)39(9,40(28,10)35(30)43-31)20-18-32-42(41)37(48-42)34(44)36(47-32)38(7,8)46-22-19-26(5)6/h11-12,14,16,19,28,32,34,36-37,43-45H,13,15,17-18,20-23H2,1-10H3/t28-,32-,34+,36-,37+,39+,40+,41-,42-/m0/s1

SMILES

CC(C)=CCOC(C)(C)[C@H]1O[C@H]2CC[C@]3(C)[C@@]4(C)c5[nH]c6ccc(CC=C(C)C)c(CC=C(C)C)c6c5C[C@@H]4CC[C@@]3(O)[C@]23O[C@@H]3[C@@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
seed.compound:cpd31213 seedM:cpd31213 kegg.compound:C20594 keggC:C20594	20,21-Diprenylterpendole J
metacyc.compound:CPD-17200 metacycM:CPD-17200 seed.compound:cpd34318 seedM:cpd34318	20,21-diprenylterpendole J
keggC:M_C20594 seedM:M_cpd31213 seedM:M_cpd34318	secondary/obsolete/fantasy identifier