(Q104924206)

English

(1S,3R,6S,8S,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-6-methyl-5-methylideneheptan-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

24-methylene-cycloartanol

1 reference

based on heuristic

inferred from SMILES

(1S,3R,6S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-6-methyl-5-methylideneheptan-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol

1 reference

based on heuristic

inferred from SMILES

3beta-24-Methylenecycloartan-3-ol

1 reference

based on heuristic

inferred from SMILES

(1S,3R,6S,8R,12S,15R,16R)-7,7,12,16-tetramethyl-15-(6-methyl-5-methylideneheptan-2-yl)pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol

1 reference

based on heuristic

inferred from SMILES

mass

440.401816284 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1S,3R,6S,8R,11R,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-6-methyl-5-methylideneheptan-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1S,3R,6S,8R,11R,12R,15S,16S)-7,7,12,16-tetramethyl-15-[(2R)-6-methyl-5-methylideneheptan-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1S,3R,6S,8S,11R,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-6-methyl-5-methylideneheptan-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol

1 reference

based on heuristic

inferred from InChIKey

24-Methylenecycloartanol

1 reference

based on heuristic

inferred from InChI

(1S,3R,6S,8S,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2S)-6-methyl-5-methylideneheptan-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol

1 reference

based on heuristic

inferred from InChI

(1R,3R,6S,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-6-methyl-5-methylideneheptan-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol

1 reference

based on heuristic

inferred from InChI

24-Methylenecycloartan-3alpha-ol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₁H₅₂O

0 references

canonical SMILES

OC1CCC23CC43CCC5(C)C(CCC5(C)C4CCC2C1(C)C)C(C)CCC(=C)C(C)C

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isomeric SMILES

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

0 references

found in taxon

Carnegiea gigantea

1 reference

stated in

Isolation of 25(27)-dehydrolanost-8-enol from Cereus giganteus and its biosynthetic implications

Rhabdodendron macrophyllum

1 reference

stated in

Ellagic acid derivatives from Rhabdodendron macrophyllum

Identifiers

InChI

InChI=1S/C31H52O/c1-20(2)21(3)9-10-22(4)23-13-15-29(8)25-12-11-24-27(5,6)26(32)14-16-30(24)19-31(25,30)18-17-28(23,29)7/h20,22-26,32H,3,9-19H2,1-2,4-8H3/t22-,23-,24-,25+,26+,28-,29+,30-,31+/m1/s1

0 references

InChIKey

BDHQMRXFDYJGII-YLWQSLEJSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q104924206)

(1S,3R,6S,8S,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-6-methyl-5-methylideneheptan-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol

Statements

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