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Teleocidin A 2

HCID 3979
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Basic information

CAS
102209-77-8
Standard SMILES
C=CC(C)(CCC=C(C)C)c1ccc2c3c(c[nH]c13)CC(CO)NC(=O)C(C(C)C)N2C
InChIKey
KISDGNGREAJPQR-UHFFFAOYSA-N
Molecular formula
C27H39N3O2
Average molar mass
437.628 g/mol
Monoisotopic mass
437.30422749

Names & identifiers

Preferred name
Teleocidin A 2
IUPAC
9-(3,7-Dimethylocta-1,6-dien-3-yl)-5-(hydroxymethyl)-1-methyl-2-(propan-2-yl)-1,2,4,5,6,8-hexahydro-3H-[1,4]diazonino[7,6,5-cd]indol-3-one
English name
TELEOCIDINA-2
Molecular formula
C27H39N3O2
Molecular weight
437.62

Names & synonyms

TELEOCIDINA-2(2S,5S)-9-[(S)-1-Ethenyl-1,5-dimethyl-4-hexenyl]-1,2,4,5,6,8-hexahydro-5-(hydroxymethyl)-1-methyl-2-isopropyl-3H-pyrrolo[4,3,2-gh]-1,4-benzodiazonin-3-one(2S,5S)-9-[(S)-1-Ethenyl-1,5-dimethyl-4-hexenyl]-1,2,4,5,6,8-hexahydro-5-(hydroxymethyl)-1-methyl-2-isopropyl-3H-pyrrolo[4,3,2-gh]-1,4-benzodiazonine-3-one3H-Pyrrolo[4,3,2-gh]-1,4-benzodiazonin-3-one, 9-[(1S)-1-ethenyl-1,5-dimethyl-4-hexen-1-yl]-1,2,4,5,6,8-hexahydro-5-(hydroxymethyl)-1-methyl-2-(1-methylethyl)-, (2S,5S)-

Database identifiers

CAS
102209-77-8、70497-14-2
PubChem CID
3979
DTXSID
DTXSID10907258
ChEMBL
CHEMBL581451
ChEBI
CHEBI:80050
Nikkaji
J122.716E

Properties

Physicochemical properties

Boiling point
665.1 · 665.1±55.0 °C(Predicted)
Density
1.06 · 1.060±0.06 g/cm3(Predicted)
pka
14.39 · 14.39±0.10(Predicted)
FDA UNII
1 OOC650 · JYJ1OOC650

Chemistry & industry

Suppliers1 total

武汉丽合智造生物科技有限公司18971458902 · [email protected]

Related reactions

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Compound notes

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