(Q105000621)

English

(1S,3R,8R,11S,12S,14S,15R,16R)-14-hydroxy-7,7,12,16-tetramethyl-15-[(2R)-1-[(2S,3S)-3-propan-2-yloxiran-2-yl]propan-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

14-Hydroxy-7,7,12,16-tetramethyl-15-[1-(3-propan-2-yloxiran-2-yl)propan-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-one

1 reference

based on heuristic

inferred from SMILES

mass

456.360345396 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₀H₄₈O₃

0 references

canonical SMILES

O=C1CCC23CC43CCC5(C)C(C(O)CC5(C)C4CCC2C1(C)C)C(C)CC6OC6C(C)C

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isomeric SMILES

CC(C)[C@@H]1O[C@H]1C[C@@H](C)[C@H]1[C@@H](O)C[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)C(=O)CC[C@@]45C[C@@]35CC[C@]12C

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found in taxon

Lindheimera texana

1 reference

stated in

Cycloartanes from Lindheimera texana

Identifiers

InChI

InChI=1S/C30H48O3/c1-17(2)25-20(33-25)14-18(3)24-19(31)15-28(7)22-9-8-21-26(4,5)23(32)10-11-29(21)16-30(22,29)13-12-27(24,28)6/h17-22,24-25,31H,8-16H2,1-7H3/t18-,19+,20+,21+,22+,24+,25+,27-,28+,29-,30+/m1/s1

0 references

InChIKey

FSFWMDIIVBHWOY-JBADRDTDSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FSFWMDIIVBHWOY-JBADRDTDSA-N

(Q105000621)

(1S,3R,8R,11S,12S,14S,15R,16R)-14-hydroxy-7,7,12,16-tetramethyl-15-[(2R)-1-[(2S,3S)-3-propan-2-yloxiran-2-yl]propan-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-one

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