(Q105134066)

English

[(1S,5Z,9R,10S,11S,12S,14R,16R)-6,14-dimethyl-2-methylidene-13-oxo-9-propan-2-yl-15,17-dioxatricyclo[8.7.0.011,16]heptadec-5-en-12-yl] 3-methylbut-2-enoate

chemical compound

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instance of

type of chemical entity

0 references

subclass of

(6,14-Dimethyl-2-methylidene-13-oxo-9-propan-2-yl-15,17-dioxatricyclo[8.7.0.011,16]heptadec-5-en-12-yl) 3-methylbut-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

430.271924316 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(1R,5E,9R,10S,11R,12R,14R,16R)-6,14-dimethyl-2-methylidene-13-oxo-9-propan-2-yl-15,17-dioxatricyclo[8.7.0.011,16]heptadec-5-en-12-yl] 3-methylbut-2-enoate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₆H₃₈O₅

0 references

canonical SMILES

O=C(OC1C(=O)C(OC2OC3C(=C)CCC=C(C)CCC(C(C)C)C3C21)C)C=C(C)C

0 references

isomeric SMILES

C=C1CC/C=C(/C)CC[C@H](C(C)C)[C@@H]2[C@@H]1O[C@@H]1O[C@H](C)C(=O)[C@@H](OC(=O)C=C(C)C)[C@H]21

0 references

found in taxon

Pittosporum tobira

1 reference

stated in

Sesquiterpene glycosides and other terpene constituents from the flowers of Pittosporum tobira

Identifiers

InChI

InChI=1S/C26H38O5/c1-14(2)13-20(27)30-25-22-21-19(15(3)4)12-11-16(5)9-8-10-17(6)24(21)31-26(22)29-18(7)23(25)28/h9,13,15,18-19,21-22,24-26H,6,8,10-12H2,1-5,7H3/b16-9-/t18-,19-,21+,22+,24-,25+,26+/m1/s1

0 references

InChIKey

JRRSUVCGCJXBHH-XFMOKPGASA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

JRRSUVCGCJXBHH-XFMOKPGASA-N

(Q105134066)

[(1S,5Z,9R,10S,11S,12S,14R,16R)-6,14-dimethyl-2-methylidene-13-oxo-9-propan-2-yl-15,17-dioxatricyclo[8.7.0.011,16]heptadec-5-en-12-yl] 3-methylbut-2-enoate

Statements

Identifiers

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