(Q105379744)

English

(3aS,6E,14E,15aS)-10-(hydroxymethyl)-6,14-dimethyl-3-methylidene-3a,4,5,8,9,12,13,15a-octahydrocyclotetradeca[b]furan-2-one

chemical compound

In more languages

Statements

type of chemical entity

0 references

1 reference

based on heuristic

inferred from SMILES

316.203844756 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3aS,6E,10E,14E,15aR)-10-(hydroxymethyl)-6,14-dimethyl-3-methylidene-3a,4,5,8,9,12,13,15a-octahydrocyclotetradeca[b]furan-2-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3aS,6E,10E,14E,15aS)-10-(hydroxymethyl)-6,14-dimethyl-3-methylidene-3a,4,5,8,9,12,13,15a-octahydrocyclotetradeca[b]furan-2-one

1 reference

based on heuristic

inferred from InChI

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₈O₃

0 references

canonical SMILES

O=C1OC2C=C(C)CCC=C(CO)CCC=C(C)CCC2C1=C

0 references

isomeric SMILES

C=C1C(=O)O[C@H]2/C=C(\C)CCC=C(CO)CC/C=C(\C)CC[C@@H]12

0 references

Lobophytum crassum

1 reference

Cytotoxic and anti-inflammatory cembranoids from the soft coral Lobophytum crassum

Identifiers

InChI=1S/C20H28O3/c1-14-6-4-8-17(13-21)9-5-7-15(2)12-19-18(11-10-14)16(3)20(22)23-19/h6,9,12,18-19,21H,3-5,7-8,10-11,13H2,1-2H3/b14-6+,15-12+,17-9?/t18-,19-/m0/s1

0 references

ZMVCRUREHOFWFQ-QJHDQRFQSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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