input word = C00050120

Metabolite InformationStructural formula
Name Holacurtinol
(+)-Holacurtinol
Formula C28H45NO6
Mw 491.32468818
CAS RN 215595-76-9
C_ID C00050120 ,
InChIKey SFUVPIJMDPWZBZ-NQWVVDSENA-N
InChICode InChI=1S/C28H45NO6/c1-15(30)21-13-23(31)28(32)20-7-6-17-12-18(35-24-14-22(33-5)25(29)16(2)34-24)8-10-26(17,3)19(20)9-11-27(21,28)4/h6,16,18-25,31-32H,7-14,29H2,1-5H3/t16-,18+,19+,20-,21-,22+,23+,24+,25-,26+,27-,28-/m1/s1
SMILES CO[C@H]1C[C@H](O[C@H]2CC[C@@]3(C)C(=CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C(C)=O)C[C@H](O)[C@]43O)C2)O[C@H](C)[C@H]1N
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Cholesterol
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeHolarrhena curtisii Ref.
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