input word = C00003655

Metabolite InformationStructural formula
Name Inokosterone
Formula C27H44O7
Mw 480.30870376
CAS RN 15130-85-5
C_ID C00003655 ,
InChIKey JQNVCUBPURTQPQ-PRHWISJANA-N
InChICode InChI=1S/C27H44O7/c1-15(14-28)5-6-23(32)26(4,33)22-8-10-27(34)17-11-19(29)18-12-20(30)21(31)13-24(18,2)16(17)7-9-25(22,27)3/h11,15-16,18,20-23,28,30-34H,5-10,12-14H2,1-4H3/t15-,16+,18+,20-,21+,22+,23-,24-,25-,26-,27-/m1/s1
SMILES [C@H]1([C@@H](C[C@@H]2[C@](C1)([C@@H]1C(=CC2=O)[C@]2([C@](CC1)([C@H](CC2)[C@]([C@@H](CC[C@@H](C)CO)O)(O)C)C)O)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaZoanthidaeZoanthus sp. Ref.
PlantaeAmaranthaceaeAchyranthes bidentata Ref.
PlantaeAmaranthaceaeAchyranthes fauriei Ref.
PlantaeAsteraceaeRhaponticum carthamoides Ref.
PlantaeBlechnaceaeWoodwardia orientalis Ref.
PlantaeMoraceaeMorus alba Ref.
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OrganismZoanthus sp.
ReferenceSuksamrarn,J.Nat.Prod.,65,(2002),1194