(Q15410946)

Eleutherobin (English)

[(1S,2S,4R,8R,9S,10Z,12R)-11-[[(2R,3S,4R,5R)-3-acetyloxy-4,5-dihydroxyoxan-2-yl]oxymethyl]-12-methoxy-1,5-dimethyl-8-propan-2-yl-15-oxatricyclo[10.2.1.04,9]pentadeca-5,10,13-trien-2-yl] 3-(1-methylimidazol-4-yl)prop-2-enoate

21 September 2016

stereoisomer of

2 references

inferred from InChIKey

[(1S,2S,4R,8R,9R,10Z,12R)-11-[[(2S,3S,4S,5S)-3-acetyloxy-4,5-dihydroxyoxan-2-yl]oxymethyl]-12-methoxy-1,5-dimethyl-8-propan-2-yl-15-oxatricyclo[10.2.1.04,9]pentadeca-5,10,13-trien-2-yl] (E)-3-(1-methylimidazol-4-yl)prop-2-enoate

inferred from InChI

2 references

[(1S,2S,4R,8R,9R,10Z,12R)-11-[[(2R,3R,4S,5R)-3-acetyloxy-4,5-dihydroxyoxan-2-yl]oxymethyl]-12-methoxy-1,5-dimethyl-8-propan-2-yl-15-oxatricyclo[10.2.1.04,9]pentadeca-5,10,13-trien-2-yl] (Z)-3-(1-methylimidazol-4-yl)prop-2-enoate

inferred from InChIKey

1 reference

1 reference

inferred from InChI

chemical formula

C₃₅H₄₈N₂O₁₀

1 reference

Eleutherobin (English)

21 September 2016

canonical SMILES

CC1=CCC(C2C1CC(C3(C=CC(O3)(C(=C2)COC4C(C(C(CO4)O)O)OC(=O)C)OC)C)OC(=O)C=CC5=CN(C=N5)C)C(C)C

1 reference

Eleutherobin (English)

21 September 2016

isomeric SMILES

CC1=CC[C@@H]([C@@H]/2[C@H]1C[C@@H]([C@@]3(C=C[C@@](O3)(/C(=C2)/CO[C@H]4[C@H]([C@@H]([C@@H](CO4)O)O)OC(=O)C)OC)C)OC(=O)/C=C/C5=CN(C=N5)C)C(C)C

1 reference

Eleutherobin (English)

Erythropodium caribaeorum

21 September 2016

found in taxon

4 references

Antimitotic diterpenes from Erythropodium caribaeorum test pharmacophore models for microtubule stabilization

Antimitotic diterpenoids from Erythropodium caribaeorum : isolation artifacts and putative biosynthetic intermediates

Antimitotic diterpenes from Erythropodium caribaeorum test pharmacophore models for microtubule stabilization

Diterpenoids from cultured Erythropodium caribaeorum

Eleutherobia

1 reference

Eleutherobin, a New Cytotoxin that Mimics Paclitaxel (Taxol) by Stabilizing Microtubules

Parasphaerasclera albiflora

1 reference

(Z)-Sarcodictyin A, a New Highly Cytotoxic Diterpenoid from the Soft Coral Bellonella albiflora

Identifiers

InChI

InChI=1S/C35H48N2O10/c1-20(2)25-10-8-21(3)26-15-29(46-30(40)11-9-24-16-37(6)19-36-24)34(5)12-13-35(42-7,47-34)23(14-27(25)26)17-43-33-32(45-22(4)38)31(41)28(39)18-44-33/h8-9,11-14,16,19-20,25-29,31-33,39,41H,10,15,17-18H2,1-7H3/b11-9+,23-14-/t25-,26+,27-,28-,29+,31-,32+,33-,34+,35-/m1/s1

1 reference

Eleutherobin (English)

21 September 2016

1 reference

Eleutherobin (English)

21 September 2016

1 reference

https://commonchemistry.cas.org/detail?cas_rn=174545-76-7

10 April 2021

1 reference

eleutherobin (English)

21 September 2016

2 references

Eleutherobin (English)

matched by identifier from

21 September 2016

1 reference

matched by identifier from

ELEUTHEROBIN (English)

21 September 2016

1 reference

1 reference

DSSTOX compound identifier

DTXCID801323516

0 references

UNII

LEW3MBQ5WM

1 reference

matched by identifier from