(Q104998796)

English

(1R,2R,5R,6R,9R,10R,13S,15R)-6,10-dimethyl-5-[(2R)-6-methylheptan-2-yl]-16,17-dioxapentacyclo[13.2.2.01,9.02,6.010,15]nonadec-18-en-13-ol

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

6,10-dimethyl-5-(6-methylheptan-2-yl)-16,17-dioxapentacyclo[13.2.2.0¹,⁹.0²,⁶.0¹⁰,¹⁵]nonadec-18-en-13-ol

1 reference

based on heuristic

inferred from SMILES

mass

416.329045268 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

5alpha,8alpha-epidioxycholest-6-en-3beta-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₇H₄₄O₃

0 references

canonical SMILES

OC1CCC2(C)C3CCC4(C)C(CCC4C53OOC2(C=C5)C1)C(C)CCCC(C)C

0 references

isomeric SMILES

CC(C)CCC[C@@H](C)[C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@@]23C=C[C@@]2(C[C@@H](O)CC[C@]12C)OO3

0 references

found in taxon

Ceratodictyon spongiosum

1 reference

stated in

Ceramides from the Taiwan Red AlgaCeratodictyon Spongiosumand Symbiotic SpongeSigmadocia Symbiotica

Identifiers

InChI

InChI=1S/C27H44O3/c1-18(2)7-6-8-19(3)21-9-10-22-24(21,4)13-12-23-25(5)14-11-20(28)17-26(25)15-16-27(22,23)30-29-26/h15-16,18-23,28H,6-14,17H2,1-5H3/t19-,20+,21-,22-,23-,24-,25-,26+,27-/m1/s1

0 references

InChIKey

FOISYVRNZSWLHL-OLLYTBDOSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FOISYVRNZSWLHL-OLLYTBDOSA-N

(Q104998796)

(1R,2R,5R,6R,9R,10R,13S,15R)-6,10-dimethyl-5-[(2R)-6-methylheptan-2-yl]-16,17-dioxapentacyclo[13.2.2.01,9.02,6.010,15]nonadec-18-en-13-ol

Statements

Identifiers

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