(Q105269669)

English

(6bS)-4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,14-diol

group of stereoisomers with the chemical formula C₃₀H₅₀O₂

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Statements

instance of

group of stereoisomers

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subclass of

oleanane triterpenoid

1 reference

inferred from

oleanane triterpenoid

mass

442.38108084 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₀H₅₀O₂

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canonical SMILES

OC1C=C2C3CC(C)(C)CCC3(C)CCC2(C)C4(C)CCC5C(C)(C)C(O)CCC5(C)C14

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isomeric SMILES

CC1(C)CCC2(C)CC[C@]3(C)C(=CC(O)C4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1

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found in taxon

Elaeodendron croceum

1 reference

stated in

Isolation and identification of poisonous triterpenoids from Elaeodendron croceum.

Identifiers

InChI

InChI=1S/C30H50O2/c1-25(2)13-14-27(5)15-16-29(7)19(20(27)18-25)17-21(31)24-28(6)11-10-23(32)26(3,4)22(28)9-12-30(24,29)8/h17,20-24,31-32H,9-16,18H2,1-8H3/t20?,21?,22?,23?,24?,27?,28?,29-,30?/m1/s1

0 references

InChIKey

UBUHIKQRNDOKCZ-ICVGKJLSSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

UBUHIKQRNDOKCZ-ICVGKJLSSA-N

(Q105269669)

(6bS)-4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,14-diol

Statements

Identifiers

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