(Q105349542)

English

(2S,3R,4R,5R,6R)-2-methyl-6-[(1R,2S,4S,5'S,6R,7S,8R,9S,12R,13R,14R,16R)-5',7,9,13-tetramethyl-14-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl]oxyoxane-3,4,5-triol

chemical compound

In more languages

Statements

type of chemical entity

0 references

2-methyl-6-{5,7',9',13'-tetramethyl-14'-[(3,4,5-trihydroxyoxan-2-yl)oxy]-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-18'-eneoxy}oxane-3,4,5-triol

1 reference

based on heuristic

inferred from SMILES

708.40847736 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₈H₆₀O₁₂

0 references

canonical SMILES

OC1COC(OC2CC(OC3OC(C)C(O)C(O)C3O)CC4=CCC5C(CCC6(C)C5CC7OC8(OCC(C)CC8)C(C)C76)C42C)C(O)C1O

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isomeric SMILES

C[C@H]1CC[C@@]2(OC1)O[C@H]1C[C@H]3[C@H]4CC=C5C[C@@H](O[C@@H]6O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)C[C@@H](O[C@@H]6OC[C@@H](O)[C@H](O)[C@H]6O)[C@]5(C)[C@@H]4CC[C@]3(C)[C@H]1[C@@H]2C

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Liriope spicata var. prolifera

1 reference

Comparative studies on the constituents of ophiopogonis tuber and its congeners. VI. Studies on the constituents of the subterranean part of Liriope spicata var. prolifera and L. muscari. (1).

Identifiers

InChI=1S/C38H60O12/c1-17-8-11-38(46-15-17)18(2)28-26(50-38)14-24-22-7-6-20-12-21(48-35-33(44)31(42)29(40)19(3)47-35)13-27(37(20,5)23(22)9-10-36(24,28)4)49-34-32(43)30(41)25(39)16-45-34/h6,17-19,21-35,39-44H,7-16H2,1-5H3/t17-,18-,19-,21+,22-,23+,24-,25+,26-,27+,28-,29-,30-,31+,32+,33+,34-,35-,36-,37-,38+/m0/s1

0 references

YJXRCUSZWRSTCL-WKBORETDSA-N

0 references

2 references

15 September 2022

matched by identifier from

YJXRCUSZWRSTCL-WKBORETDSA-N

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