(2R,3S,9R)-5-acetyl-4-hydroxy-8,8-dimethyl-7,16-diazapentacyclo[9.6.1.0²,⁹.0³,⁷.0¹⁵,¹⁸]octadeca-1(17),4,11(18),12,14-pentaen-6-one

Compound number:
MolPort-003-983-745
CAS number: 18172-33-3
IUPAC:
(2R,3S,9R)-5-acetyl-4-hydroxy-8,8-dimethyl-7,16-diazapentacyclo[9.6.1.0²,⁹.0³,⁷.0¹⁵,¹⁸]octadeca-1(17),4,11(18),12,14-pentaen-6-one
IUPAC traditional:
cyclopiazonic acid
SMILES:
CC(=O)C1=C(O)[C@@H]2[C@@H]3[C@@H](Cc4cccc5[nH]cc3c45)C(C)(C)N2C1=O |r,c:3|
InChI key:
SZINUGQCTHLQAZ-DQYPLSBCSA-N
Molecular formula:
C20H20N2O3
Molecular weight: 336.391
Sample Reformatting

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Supplier Catalogue Data


Catalog: Screening compound Ships out: 5 business days Purity: >98%
Last updated: this month In warehouse: Unverified
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10 mg October 23, 2019 171.10 USD
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50 mg October 23, 2019 660.80 USD
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Supplier Catalogue Data


Catalog: Building blocks Ships out: 10 business days Purity: 98%
Last updated: this month In warehouse: 40.00 mg
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5 mg October 30, 2019 190.00 USD
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10 mg October 30, 2019 328.00 USD
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S&H to USA: 77.00 USD
S&H to World: 154.00 USD

Supplier Catalogue Data


Catalog: Building blocks Ships out: 10 business days Purity: > 99%
Last updated: > 3 months ago In warehouse: Unverified
Pack size Ships out Price Qty
10 mg October 30, 2019 120.16 USD
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More Information

Compound Identifiers
Compound number: MolPort-003-983-745
CAS number: 18172-33-3

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000100061481
0
9H-Pyrrolo[1',2':2,3]isoindolo[4,5,6-cd]indol-9-one, 10-acetyl-2,6,6a,7,11a,11b-hexahydro-11-hydroxy-7,7-dimethyl-, (6aR,11aS,11bR)-
9H-Pyrrolo[1',2':2,3]isoindolo[4,5,6-cd]indol-9-one,10-acetyl-2,6,6a,7,11a,11b-hexahydro-11-hydroxy-7,7-dimethyl-,(6aR,11aS,11bR)-rel-
a-Cyclopiazonic acid |
Cyclopiazonic Acid

InChI
InChI: 1S/C20H20N2O3/c1-9(23)14-18(24)17-16-11-8-21-13-6-4-5-10(15(11)13)7-12(16)20(2,3)22(17)19(14)25/h4-6,8,12,16-17,21,24H,7H2,1-3H3/t12-,16+,17+/m1/s1
InChI key: SZINUGQCTHLQAZ-DQYPLSBCSA-N

Calculated Properties
Molecular formula: C20H20N2O3
Molecular weight: 336.391

Other

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2019 MolPort, v3.22, release date 14-10-2019 15:00 (+0200). All rights reserved.
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