input word = C00047521

Metabolite InformationStructural formula
Name Neoabieslactone D
(-)-Neoabieslactone D
Formula C30H42O4
Mw 466.30830983
CAS RN 1159913-84-4
C_ID C00047521 ,
InChIKey MBPSURWEKIBRPI-SBLSRANANA-N
InChICode InChI=1S/C30H42O4/c1-18-16-29(33-24(18)32)17-19(2)30(34-29)15-14-27(6)21-8-9-22-25(3,4)23(31)11-12-26(22,5)20(21)10-13-28(27,30)7/h16,19,22H,8-15,17H2,1-7H3/t19-,22-,26-,27+,28+,29-,30+/m1/s1
SMILES C1C2=C([C@]3([C@](C1)([C@@]1(CC3)O[C@]3(C[C@H]1C)OC(=O)C(=C3)C)C)C)CC[C@H]1[C@@]2(CCC(=O)C1(C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePinaceaeAbies chensiensis Ref.
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OrganismAbies chensiensis
ReferenceLi,J.Nat.Prod.,72,(2009),1065