(Q105157687)

English

(3R,4aR,6aS,6aS,6bR,8aS,12aR,14aS,14bR)-4,4,6a,6a,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,6b,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-ol

chemical compound

In more languages

Statements

type of chemical entity

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taraxerane triterpenoid

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428.401816284 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₀H₅₂O

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canonical SMILES

OC1CCC2(C)C(CCC3(C)C4CCC5(C)CCC(C)(C)CC5C4(C)CCC23)C1(C)C

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isomeric SMILES

CC1(C)CC[C@]2(C)CC[C@H]3[C@]4(C)CC[C@H]5C(C)(C)[C@H](O)CC[C@]5(C)[C@H]4CC[C@@]3(C)[C@@H]2C1

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Ajania fruticulosa

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Biological and phytochemical investigations on Ajania fruticulosa

Identifiers

InChI=1S/C30H52O/c1-25(2)17-18-27(5)13-9-21-29(7)14-10-20-26(3,4)24(31)12-16-28(20,6)22(29)11-15-30(21,8)23(27)19-25/h20-24,31H,9-19H2,1-8H3/t20-,21-,22+,23+,24+,27-,28-,29-,30+/m0/s1

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LUXKWJMFHFPKHS-ZIUOSIHNSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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