(Q105204255)

English

methyl 2-[(1R,6R)-4-[(R)-acetyloxy-[(1R,5R,8aR)-1-(furan-3-yl)-5-hydroxy-8a-methyl-3,6-dioxo-7,8-dihydro-1H-isochromen-5-yl]methyl]-2,2,6-trimethyl-5-oxocyclohex-3-en-1-yl]acetate

chemical compound

In more languages

edit

Statements

instance of

type of chemical entity

0 references

subclass of

methyl 2-[4-[acetyloxy-[1-(furan-3-yl)-5-hydroxy-8a-methyl-3,6-dioxo-7,8-dihydro-1H-isochromen-5-yl]methyl]-2,2,6-trimethyl-5-oxocyclohex-3-en-1-yl]acetate

1 reference

based on heuristic

inferred from SMILES

mass

542.215197288 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₉H₃₄O₁₀

0 references

canonical SMILES

O=C1OC(C2=COC=C2)C3(C(=C1)C(O)(C(=O)CC3)C(OC(=O)C)C4=CC(C)(C)C(CC(=O)OC)C(C4=O)C)C

0 references

isomeric SMILES

COC(=O)C[C@@H]1[C@@H](C)C(=O)C([C@@H](OC(C)=O)[C@@]2(O)C(=O)CC[C@]3(C)C2=CC(=O)O[C@H]3c2ccoc2)=CC1(C)C

0 references

found in taxon

Xylocarpus granatum

3 references

stated in

Xylogranatins A-D, new mexicanolides from the fruit of a Chinese mangrove Xylocarpus granatum

stated in

Xylogranatins F-R: antifeedants from the Chinese mangrove, Xylocarpus granatum, a new biogenetic pathway to tetranortriterpenoids

stated in

Xylogranatins A-D: novel tetranortriterpenoids with an unusual 9,10-seco scaffold from marine mangrove Xylocarpus granatum.

Identifiers

InChI

InChI=1S/C29H34O10/c1-15-19(11-22(32)36-6)27(3,4)13-18(24(15)34)26(38-16(2)30)29(35)20-12-23(33)39-25(17-8-10-37-14-17)28(20,5)9-7-21(29)31/h8,10,12-15,19,25-26,35H,7,9,11H2,1-6H3/t15-,19-,25+,26-,28-,29+/m1/s1

0 references

InChIKey

OZYCYLSFCHKMLB-RHXUDSMWSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OZYCYLSFCHKMLB-RHXUDSMWSA-N

1 reference

(Q105204255)

methyl 2-[(1R,6R)-4-[(R)-acetyloxy-[(1R,5R,8aR)-1-(furan-3-yl)-5-hydroxy-8a-methyl-3,6-dioxo-7,8-dihydro-1H-isochromen-5-yl]methyl]-2,2,6-trimethyl-5-oxocyclohex-3-en-1-yl]acetate

Statements

Identifiers

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)