input word = C00041591

Metabolite InformationStructural formula
Name Homaxisterol B2
Formula C29H46O4
Mw 458.33960996
CAS RN 877373-34-7
C_ID C00041591 ,
InChIKey NUKZQEACWUKJTB-KGLWHAKLNA-N
InChICode InChI=1S/C29H46O4/c1-7-19(17(2)3)9-8-18(4)21-10-11-22-25(21,5)14-15-28-26(6)13-12-20(30)16-27(26)24(32-27)23(31)29(22,28)33-28/h8-9,17-24,30-31H,7,10-16H2,1-6H3/b9-8+/t18-,19-,20-,21+,22+,23+,24-,25+,26-,27-,28-,29+/m0/s1
SMILES C1[C@@]23[C@@]([C@H]4[C@](C1)([C@H](CC4)[C@@H](C)/C=C/[C@@H](C(C)C)CC)C)([C@@H]([C@H]1[C@@]4([C@@]2(CC[C@@H](C4)O)C)O1)O)O3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaSuberitidaeHomaxinella sp. Ref.
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OrganismHomaxinella sp.
ReferenceManssor,J.Nat.Prod.,69,(2006),131