input word = C00055210

Metabolite InformationStructural formula
Name Actinidic acid
Formula C30H46O5
Mw 486.33452458
CAS RN 341971-45-7
C_ID C00055210
InChIKey FFMVHFPLIIYYNC-QXIFDOFRSA-N
InChICode InChI=1S/C30H46O5/c1-17-9-12-30(25(34)35)14-13-28(5)19(23(30)18(17)2)7-8-22-26(3)15-20(32)24(33)27(4,16-31)21(26)10-11-29(22,28)6/h7,18,20-24,31-33H,1,8-16H2,2-6H3,(H,34,35)/t18-,20+,21+,22+,23-,24-,26-,27-,28+,29+,30-/m0/s1
SMILES C=C1CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2[C@H]1C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeActinidiaceaeActinidia deliciosa cv. Golden King Ref.
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OrganismActinidia deliciosa cv. Golden King
ReferenceSashida, Y. et al., Phytochemistry, 1992, 31, 2801-2804 (isol, pmr, cmr)