CAS
302-97-6 Purity
95%+
302-97-6 Purity
95%+
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17-Iodoandrosta-5,16-dien-3beta-ol
CAS
32138-69-5
Catalog Number
ACM32138695
Category
Steroidal Compounds
Molecular Weight
398.32
Molecular Formula
C19H27IO
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Specification
Synonyms
32138-69-5, (3S,8R,9S,10R,13S,14S)-17-Iodo-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol, SureCN939291, CTK8B9647, AMX10149, ANW-62842, AKOS016004244, 17-Iodoandrosta-5,16-dien-3beta-ol, AK101607, KB-207662
IUPAC Name
(3S,8R,9S,10R,13S,14S)-17-iodo-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-ol
Canonical SMILES
CC12CCC(CC1=CCC3C2CCC4(C3CC=C4I)C)O
InChI Key
DHZJEYGWSNDRGN-USOAJAOKSA-N
Exact Mass
398.11100
H-Bond Acceptor
1
H-Bond Donor
1
What is the molecular formula of 17-Iodoandrosta-5,16-dien-3beta-ol?
The molecular formula of 17-Iodoandrosta-5,16-dien-3beta-ol is C19H27IO.
When was the structure of 17-Iodoandrosta-5,16-dien-3beta-ol created and modified?
The structure was created on 2006-10-26 and modified on 2023-11-25.
What is the IUPAC Name of 17-Iodoandrosta-5,16-dien-3beta-ol?
The IUPAC Name of 17-Iodoandrosta-5,16-dien-3beta-ol is (3S,8R,9S,10R,13S,14S)-17-iodo-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-ol.
What is the InChIKey of 17-Iodoandrosta-5,16-dien-3beta-ol?
The InChIKey of 17-Iodoandrosta-5,16-dien-3beta-ol is DHZJEYGWSNDRGN-USOAJAOKSA-N.
What is the Canonical SMILES of 17-Iodoandrosta-5,16-dien-3beta-ol?
The Canonical SMILES of 17-Iodoandrosta-5,16-dien-3beta-ol is CC12CCC(CC1=CCC3C2CCC4(C3CC=C4I)C)O.
What is the molecular weight of 17-Iodoandrosta-5,16-dien-3beta-ol?
The molecular weight of 17-Iodoandrosta-5,16-dien-3beta-ol is 398.3 g/mol.
What is the European Community (EC) Number of 17-Iodoandrosta-5,16-dien-3beta-ol?
The European Community (EC) Number of 17-Iodoandrosta-5,16-dien-3beta-ol is 692-056-3.
What is the XLogP3-AA value of 17-Iodoandrosta-5,16-dien-3beta-ol?
The XLogP3-AA value of 17-Iodoandrosta-5,16-dien-3beta-ol is 4.7.
How many hydrogen bond donor counts does 17-Iodoandrosta-5,16-dien-3beta-ol have?
17-Iodoandrosta-5,16-dien-3beta-ol has 1 hydrogen bond donor count.
What is the topological polar surface area of 17-Iodoandrosta-5,16-dien-3beta-ol?
The topological polar surface area of 17-Iodoandrosta-5,16-dien-3beta-ol is 20.2Ų.
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