input word = C00003527

Metabolite InformationStructural formula
Name Cauloside A
(+)-Cauloside A
Hederagenin 3-O-alpha-L-arabinopyranoside
Hederagenin 3-O-arabinoside
Leontoside A
Formula C35H56O8
Mw 604.39751876
CAS RN 17184-21-3
C_ID C00003527 ,
InChIKey QUBNLZCADIYAFW-QQTXJTAONA-N
InChICode InChI=1S/C35H56O8/c1-30(2)13-15-35(29(40)41)16-14-33(5)20(21(35)17-30)7-8-24-31(3)11-10-25(43-28-27(39)26(38)22(37)18-42-28)32(4,19-36)23(31)9-12-34(24,33)6/h7,21-28,36-39H,8-19H2,1-6H3,(H,40,41)/t21-,22-,23+,24+,25-,26-,27-,28+,31-,32-,33+,34+,35-/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]6OC[C@H](O)[C@H](O)C6O)[C@@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
Plantae--Lonicera nigra Ref.
PlantaeAraliaceaeHedera helix Ref.
PlantaeAraliaceaeSchefflera capitata Harms. Ref.
PlantaeBerberidaceaeCaulophyllum robustum Ref.
PlantaeBerberidaceaeCaulophyllum thalictroides L. Michx. Ref.
PlantaeCaprifoliaceaePatrinia scabiosaefolia Ref.
PlantaeLardizabalaceaeAkebiae quinata Ref.
PlantaeRanunculaceaePulsatilla campanella Ref.
PlantaeRanunculaceaePulsatilla dahurica Ref.
PlantaeSapindaceaeSapindus mukorossi Ref.
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OrganismHedera helix
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter53