input word = C00030011

Metabolite InformationStructural formula
Name Caryocaroside II-5
(+)-Caryocaroside II-5
Copteroside B
(+)-Copteroside B
Formula C36H56O10
Mw 648.38734801
CAS RN 85889-27-6
C_ID C00030011 ,
InChIKey DYFUVQSGLMQLRX-AGFWWLONNA-N
InChICode InChI=1S/C36H56O10/c1-31(2)13-15-36(30(43)44)16-14-34(5)19(20(36)17-31)7-8-22-32(3)11-10-23(33(4,18-37)21(32)9-12-35(22,34)6)45-29-26(40)24(38)25(39)27(46-29)28(41)42/h7,20-27,29,37-40H,8-18H2,1-6H3,(H,41,42)(H,43,44)/t20-,21+,22+,23-,24-,25-,26+,27-,29+,32-,33+,34+,35+,36-/m0/s1
SMILES CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]6O)[C@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaeAcanthopanax senticosus Ref.
PlantaeCampanulaceae/LobeliaceaeCodonopsis lanceolata Ref.
PlantaeCaryocaraceaeCaryocar villosum Ref.
PlantaeChenopodiaceaeClimacoptera transoxana Ref.
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