Viewing Compound With Structures

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Compound Report Overview

Compound Name: NORGESTREL
Compound Identifier: 700591
Mol Structure 2D: 700591
Molecular Weight: 312
Formula: C21 H28 O2
Development Status: US FDA Approved
SMILES: CCC12CCC3C(CCC4=CC(=O)CCC34)C2CCC1(O)C#C
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100222182D 0 0.00000 0.00000 0^^ 27 30 0 0 0 999 V2000^ -1.4125 2.2083 0.0000 C 0 0 1 0 0 0 0 0 0^ -1.4125 1.4625 0.0000 C 0 0 2 0 0 0 0 0 0^ -3.3833 0.3250 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.0708 1.0958 0.0000 C 0 0 1 0 0 0 0 0 0^ -2.7208 1.4833 0.0000 C 0 0 1 0 0 0 0 0 0^ -3.3833 1.0958 0.0000 C 0 0 1 0 0 0 0 0 0^ -0.7000 2.4458 0.0000 C 0 0 2 0 0 0 0 0 0^ -4.0375 -0.0500 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.2333 2.6625 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.0708 2.5958 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.7208 2.2333 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.0708 0.3250 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.7000 1.2333 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.3625 3.0208 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.0375 1.4833 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.7208 -0.0500 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.6958 0.3250 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.2500 1.8708 0.0000 C 0 0 0 0 0 0 0 0 0^ -5.3333 -0.0542 0.0000 O 0 0 0 0 0 0 0 0 0^ -4.6958 1.0958 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.9708 3.1833 0.0000 O 0 0 0 0 0 0 0 0 0^ -1.4125 2.9833 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.0708 3.3625 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.4125 0.7000 0.0000 H 0 0 0 0 0 0 0 0 0^ -2.0708 1.8458 0.0000 H 0 0 0 0 0 0 0 0 0^ -2.7250 0.6708 0.0000 H 0 0 0 0 0 0 0 0 0^ -3.3833 1.8208 0.0000 H 0 0 0 0 0 0 0 0 0^ 2 1 1 0 0 0^ 3 6 1 0 0 0^ 4 2 1 0 0 0^ 5 11 1 0 0 0^ 6 5 1 0 0 0^ 7 1 1 0 0 0^ 8 3 2 0 0 0^ 9 7 1 0 0 0^ 10 1 1 0 0 0^ 11 10 1 0 0 0^ 12 4 1 0 0 0^ 13 2 1 0 0 0^ 14 9 3 0 0 0^ 15 6 1 0 0 0^ 16 12 1 0 0 0^ 17 20 1 0 0 0^ 18 7 1 0 0 0^ 19 17 2 0 0 0^ 20 15 1 0 0 0^ 7 21 1 1 0 0^ 1 22 1 1 0 0^ 23 22 1 0 0 0^ 2 24 1 6 0 0^ 4 25 1 1 0 0^ 5 26 1 6 0 0^ 6 27 1 1 0 0^ 18 13 1 0 0 0^ 5 4 1 0 0 0^ 3 16 1 0 0 0^ 17 8 1 0 0 0^M END^^
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