input word = C00054642

Metabolite InformationStructural formula
Name Camelliagenin B
Formula C30H48O5
Mw 488.35017464
CAS RN 14511-74-1
C_ID C00054642
InChIKey RJEBVLDZINEMCO-CUCCWGAISA-N
InChICode InChI=1S/C30H48O5/c1-25(2)13-19-18-7-8-21-26(3)11-10-22(33)27(4,16-31)20(26)9-12-28(21,5)29(18,6)15-24(35)30(19,17-32)23(34)14-25/h7,16,19-24,32-35H,8-15,17H2,1-6H3/t19-,20+,21+,22-,23-,24+,26-,27-,28+,29+,30+/m0/s1
SMILES CC1(C)C[C@H](O)[C@]2(CO)[C@H](O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(C=O)[C@@H]5CC[C@]43C)[C@@H]2C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTheaceaeCamellia japonica Ref.
PlantaeTheaceaeCamellia sasanqua Ref.
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OrganismCamellia sasanqua
ReferenceIto, S. et al., Tet. Lett., 1967, 591 (struct)