(2,6,8,12-tetrahydroxy-3,7,11-trimethyl-14-oxo-4-propan-2-yl-13-oxatetracyclo[5.5.3.01,8.02,6]pentadec-3-en-5-yl) 1H-pyrrole-2-carboxylate
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![(2,6,8,12-tetrahydroxy-3,7,11-trimethyl-14-oxo-4-propan-2-yl-13-oxatetracyclo[5.5.3.01,8.02,6]pentadec-3-en-5-yl) 1H-pyrrole-2-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/6b14c14aabb94fdda25d33580d31adf6.png "(2,6,8,12-tetrahydroxy-3,7,11-trimethyl-14-oxo-4-propan-2-yl-13-oxatetracyclo[5.5.3.01,8.02,6]pentadec-3-en-5-yl) 1H-pyrrole-2-carboxylate")
(2,6,8,12-tetrahydroxy-3,7,11-trimethyl-14-oxo-4-propan-2-yl-13-oxatetracyclo[5.5.3.01,8.02,6]pentadec-3-en-5-yl) 1H-pyrrole-2-carboxylate
structure -
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CAS No:
6883-31-4
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Formula:
C25H33NO8
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Chemical Name:
(2,6,8,12-tetrahydroxy-3,7,11-trimethyl-14-oxo-4-propan-2-yl-13-oxatetracyclo[5.5.3.01,8.02,6]pentadec-3-en-5-yl) 1H-pyrrole-2-carboxylate
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Synonyms:
3a,4,7a,8a-tetrahydroxy-3,5,8-trimethyl-10-oxo-2-(propan-2-yl)-3a,4,5,6,7,7a,8,8a-octahydro-1h-3b,8-(epoxyethano)cyclopenta[a]inden-1-yl 1h-pyrrole-2-carboxylate;DTXSID00988531;6883-31-4
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CAS No:
(2,6,8,12-tetrahydroxy-3,7,11-trimethyl-14-oxo-4-propan-2-yl-13-oxatetracyclo[5.5.3.01,8.02,6]pentadec-3-en-5-yl) 1H-pyrrole-2-carboxylate Basic Attributes
475.5 g/mol
475.22061701 g/mol
Toxicity
| Name | Type of Test | Exposure Route | Species Observed | Dose/Duration | Toxic Effects | Reference |
|---|---|---|---|---|---|---|
| ACUTE TOXICITY DATA | LD50 - Lethal dose, 50 percent kill | Intraperitoneal | Rodent - mouse | >20 mg/kg | Details of toxic effects not reported other than lethal dose value-- | Biochemical and Biophysical Research Communications. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 128,449,1985 |
Computed Properties
Molecular Weight:475.5
XLogP3:-0.1
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:4
Exact Mass:475.22061701
Monoisotopic Mass:475.22061701
Topological Polar Surface Area:149
Heavy Atom Count:34
Complexity:980
Undefined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Learn More Other Chemicals
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(6,9,11,13,14-pentahydroxy-3,7,10-trimethyl-2-oxo-11-propan-2-yl-15-oxapentacyclo[7.5.1.01,6.07,13.010,14]pentadec-3-en-12-yl) 1H-pyrrole-2-carboxylate
106821-52-7
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[(2R,3S,6S,7R,9R,10S,11S,12R,13S,14R)-2,6,9,11,13,14-hexahydroxy-11-[(2S)-1-hydroxypropan-2-yl]-3,7,10-trimethyl-15-oxapentacyclo[7.5.1.01,6.07,13.010,14]pentadecan-12-yl] 1H-pyrrole-2-carboxylate
106821-56-1
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[(1R,3S,6S,7R,9R,10S,11S,12R,13S,14R)-6,9,11,13,14-pentahydroxy-3,7,10-trimethyl-2-oxo-11-propan-2-yl-15-oxapentacyclo[7.5.1.01,6.07,13.010,14]pentadecan-12-yl] 1H-pyrrole-2-carboxylate
97457-26-6
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cyanomethyl 1H-pyrrole-2-carboxylate Formula
500576-60-3
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[2,3,6,9,11,13,14-heptahydroxy-3-(hydroxymethyl)-7,10-dimethyl-11-propan-2-yl-15-oxapentacyclo[7.5.1.01,6.07,13.010,14]pentadecan-12-yl] 1H-pyrrole-2-carboxylate Formula
106821-51-6
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(12,13-dihydroxy-14-oxo-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecan-4-yl) 1H-pyrrole-2-carboxylate Formula
103847-10-5
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[3-[(4-azidobenzoyl)oxymethyl]-2,3,6,9,11,13,14-heptahydroxy-7,10-dimethyl-11-propan-2-yl-15-oxapentacyclo[7.5.1.01,6.07,13.010,14]pentadecan-12-yl] 1H-pyrrole-2-carboxylate Structure
154504-97-9
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