(Q105378738)

English

[8-Formyl-7-(hydroxymethyl)-1,1,4a,6a,10b-pentamethyl-2,3,4,4b,5,6,7,10,10a,11,12,12a-dodecahydrochrysen-6-yl] acetate

group of stereoisomers with the chemical formula C₂₇H₄₂O₄

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instance of

group of stereoisomers

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subclass of

scalarane sesterterpenoid

1 reference

inferred from

scalarane sesterterpenoid

mass

430.308309824 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₇H₄₂O₄

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canonical SMILES

O=CC1=CCC2C3(C)CCC4C(C)(C)CCCC4(C)C3CC(OC(=O)C)C2(C)C1CO

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Identifiers

InChI

InChI=1S/C27H42O4/c1-17(30)31-23-14-22-25(4)12-7-11-24(2,3)20(25)10-13-26(22,5)21-9-8-18(15-28)19(16-29)27(21,23)6/h8,15,19-23,29H,7,9-14,16H2,1-6H3

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InChIKey

ZKTHELRJMLNXBB-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ZKTHELRJMLNXBB-UHFFFAOYSA-N

(Q105378738)

[8-Formyl-7-(hydroxymethyl)-1,1,4a,6a,10b-pentamethyl-2,3,4,4b,5,6,7,10,10a,11,12,12a-dodecahydrochrysen-6-yl] acetate

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Identifiers

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