input word = C00043013

Metabolite InformationStructural formula
Name Sodwanone S
(+)-Sodwanone S
Formula C30H50O5
Mw 490.36582471
CAS RN 865308-60-7
C_ID C00043013 ,
InChIKey KKTMKQNIICOHDR-RIJXZYPRNA-N
InChICode InChI=1S/C30H50O5/c1-19-9-11-21-20(10-12-23(31)26(2,3)34-21)28(19,6)16-13-22-29(7)17-14-24(32)27(4,5)35-25(29)15-18-30(22,8)33/h10,19,21-23,25,31,33H,9,11-18H2,1-8H3/t19-,21-,22-,23-,25-,28-,29-,30-/m0/s1
SMILES C[C@H]1CC[C@@H]2OC(C)(C)[C@@H](O)CC=C2[C@@]1(C)CC[C@H]1[C@]2(C)CCC(=O)C(C)(C)O[C@H]2CC[C@]1(C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaAxinellidaeAxinella weltneri Ref.
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