1-(6-{[(1S,3aS,3bR,9bS,11aS)-7-methoxy-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]amino}hexyl)-2,5-dihydro-1H-pyrrole-2,5-dione



Compound number:
MolPort-003-959-868
CAS number: 112648-68-7
IUPAC:
1-(6-{[(1S,3aS,3bR,9bS,11aS)-7-methoxy-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]amino}hexyl)-2,5-dihydro-1H-pyrrole-2,5-dione
IUPAC traditional:
1-(6-{[(1S,3aS,3bR,9bS,11aS)-7-methoxy-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H-cyclopenta[a]phenanthren-1-yl]amino}hexyl)pyrrole-2,5-dione
SMILES:
COc1ccc2[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CCc2c1)NCCCCCCN1C(=O)C=CC1=O |c:34|
InChI key:
LUFAORPFSVMJIW-ZRJUGLEFSA-N
Molecular formula:
C29H40N2O3
Molecular weight: 464.65
Solubility: not available

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Catalog: Screening compound Ships out: 2 business days Purity: 99.0
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10 mg September 23, 2020 114.95 USD
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10 mg September 28, 2020 180.29 USD
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50 mg September 28, 2020 698.17 USD
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5 mg October 12, 2020 66.55 USD
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Catalog: Building blocks Ships out: 7 business days Purity: 98+%
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Catalog: Building blocks Ships out: 2 business days Purity: 97%
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5 mg September 23, 2020 155.00 USD
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50 mg September 23, 2020 842.00 USD
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Catalog: Building blocks Ships out: 7 business days Purity: 98+%
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Catalog: Building blocks Ships out: 10 business days Purity: >98%
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5 mg October 5, 2020 60.00 USD
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Catalog: Building blocks Ships out: 10 business days Purity: > 98%
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10 mg October 5, 2020 178.01 USD
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Catalog: Building blocks Ships out: 10 business days Purity: 98+%
Last updated: this week In warehouse: 734.40 mg
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1 mg October 5, 2020 51.00 USD
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5 mg October 5, 2020 79.00 USD
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0.01 g October 5, 2020 114.00 USD
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Catalog: Building blocks Ships out: 10 business days Purity: 98+%
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5 mg October 5, 2020 162.00 USD
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0.01 g October 5, 2020 173.00 USD
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Catalog: Building blocks Ships out: 3 business days Purity: 98+%
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1 mg September 24, 2020 18.00 USD
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5 mg September 24, 2020 76.00 USD
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10 mg September 24, 2020 121.00 USD
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More Information

Compound Identifiers
Compound number: MolPort-003-959-868
CAS number: 112648-68-7

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000003778899
MFCD00893825
1-[6-[[(17?)-3-methoxyestra-1,3,5(10)-trien-17-yl]amino]hexyl]-1H-pyrrole-2,5-dione
1-[6-[[(17β)-3-Methoxyestra-1,3,5(10)-trien-17-yl]amino]hexyl]-1H-pyrrole-2,5-dione
1-(6-{[(1S,10R,11S,14S,15S)-5-methoxy-15-methyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-2(7),3,5-trien-14-yl]amino}hexyl)-2,5-dihydro-1H-pyrrole-2,5-dione
1-[6-((8R,9S,13S,14S,17S)-3-Methoxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-17-ylamino)-hexyl]-pyrrole-2,5-dione
1H-Pyrrole-2,5-dione, 1-[6-[[(17b)-3-methoxyestra-1,3,5(10)-trien-17-yl]amino]hexyl]-
U 73122
U-73122
U73122

InChI
InChI: 1S/C29H40N2O3/c1-29-16-15-23-22-10-8-21(34-2)19-20(22)7-9-24(23)25(29)11-12-26(29)30-17-5-3-4-6-18-31-27(32)13-14-28(31)33/h8,10,13-14,19,23-26,30H,3-7,9,11-12,15-18H2,1-2H3/t23-,24-,25+,26+,29+/m1/s1
InChI key: LUFAORPFSVMJIW-ZRJUGLEFSA-N

Calculated Properties
Molecular formula: C29H40N2O3
Molecular weight: 464.65

Other

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2020 MolPort, v3.9, release date 08-09-2020 15:00 (+0200). All rights reserved.
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