(Q105182942)

English

2-[(3R,4aS,6aR,6bS,8aR,12aR,14aR,14bS)-4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]acetic acid

chemical compound

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Statements

type of chemical entity

0 references

2-(4,4,6a,6b,8a,11,11,14b-Octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl)acetic acid

1 reference

based on heuristic

inferred from SMILES

468.396730904 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₂H₅₂O₂

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canonical SMILES

O=C(O)CC1CCC2(C)C3CC=C4C5CC(C)(C)CCC5(C)CCC4(C)C3(C)CCC2C1(C)C

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isomeric SMILES

CC1(C)CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](CC(=O)O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1

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Artemisia argyi

1 reference

Studies on the constituents of Artemisia argyi LEVL et VANT

Identifiers

InChI=1S/C32H52O2/c1-27(2)15-16-29(5)17-18-31(7)22(23(29)20-27)9-10-25-30(6)13-11-21(19-26(33)34)28(3,4)24(30)12-14-32(25,31)8/h9,21,23-25H,10-20H2,1-8H3,(H,33,34)/t21-,23+,24+,25-,29-,30+,31-,32-/m1/s1

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NPAQHLOHQFGVKW-GEHGUXKXSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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