(Q105120125)

English

(1R,2R,4S,7S,8S,10S,11R,12R,13S,18R)-7-(furan-3-yl)-10,13-dihydroxy-1,8,12,17,17-pentamethyl-3,6,16-trioxapentacyclo[9.9.0.02,4.02,8.012,18]icosane-5,15,20-trione

chemical compound

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instance of

type of chemical entity

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subclass of

7-(furan-3-yl)-10,13-dihydroxy-1,8,12,17,17-pentamethyl-3,6,16-trioxapentacyclo[9.9.0.0²,⁴.0²,⁸.0¹²,¹⁸]icosane-5,15,20-trione

1 reference

based on heuristic

inferred from SMILES

mass

488.204632604 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₆H₃₂O₉

0 references

canonical SMILES

O=C1OC(C)(C)C2CC(=O)C3(C)C(C(O)CC4(C)C(OC(=O)C5OC534)C6=COC=C6)C2(C)C(O)C1

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isomeric SMILES

CC1(C)OC(=O)C[C@H](O)[C@@]2(C)[C@H]1CC(=O)[C@]1(C)[C@@H]2[C@@H](O)C[C@@]2(C)[C@H](c3ccoc3)OC(=O)[C@H]3O[C@]321

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found in taxon

Clausena excavata

1 reference

stated in

Counlarins, limonoids and an alkaloid from Clausena excavata

Identifiers

InChI

InChI=1S/C26H32O9/c1-22(2)14-8-16(29)25(5)18(24(14,4)15(28)9-17(30)34-22)13(27)10-23(3)19(12-6-7-32-11-12)33-21(31)20-26(23,25)35-20/h6-7,11,13-15,18-20,27-28H,8-10H2,1-5H3/t13-,14-,15-,18+,19-,20+,23-,24+,25+,26+/m0/s1

0 references

InChIKey

ITMCBHIQGZAEPX-HHYXVIOUSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105120125)

(1R,2R,4S,7S,8S,10S,11R,12R,13S,18R)-7-(furan-3-yl)-10,13-dihydroxy-1,8,12,17,17-pentamethyl-3,6,16-trioxapentacyclo[9.9.0.02,4.02,8.012,18]icosane-5,15,20-trione

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Identifiers

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