CAS No.: 1026791-61-6 — Org-26576 (Org-26576)

1. Primary Information

English name:	Org-26576
CAS No.:	1026791-61-6
Molecular formula:	C₁₁H₁₂N₂O₂
Molecular weight:	204.22 g/mol
SMILES:	C1CC2COC3=C(C=CC=N3)C(=O)N2C1
Structural class:
Other identifiers:	Org 26576

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	5mg	99%	680	-20℃	in stock	-
Kehua Intelligence	10mg	99%	1200	-20℃	in stock	-
Kehua Intelligence	50mg	99%	3600	-20℃	in stock	-
Kehua Intelligence	100mg	99%	6000	-20℃	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 27 29 0 1 0 0 0 0 0999 V2000 0.2511 1.4143 1.1218 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2842 -2.4571 0.6777 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4203 -0.5575 -0.0178 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3799 1.3761 0.2461 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4108 0.7656 -0.6371 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8685 1.0021 -1.0413 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6557 0.1605 -0.0396 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7721 -1.0625 0.1513 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8748 1.8224 0.3337 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2868 -1.2970 0.2758 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 -0.6070 0.0631 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2073 0.7262 0.4194 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -1.3049 -0.5092 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2792 -0.6540 -0.7159 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3817 0.6727 -0.3281 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7739 0.7318 -1.5297 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0389 0.6098 -2.0517 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 2.0564 -1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7554 0.7048 0.9069 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6580 -0.0961 -0.3934 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8893 -1.5351 1.1307 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9483 -1.8127 -0.6273 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6154 2.7404 -0.2077 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6527 2.0971 1.0557 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9633 -2.3444 -0.8069 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1193 -1.1701 -1.1666 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3079 1.2206 -0.4675 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 12 1 0 0 0 0 2 10 2 0 0 0 0 3 5 1 0 0 0 0 3 8 1 0 0 0 0 3 10 1 0 0 0 0 4 12 1 0 0 0 0 4 15 2 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

(7S)-9-oxa-3,11-diazatricyclo[8.4.0.03,7]tetradeca-1(10),11,13-trien-2-one

4.2 InChI

InChI=1S/C11H12N2O2/c14-11-9-4-1-5-12-10(9)15-7-8-3-2-6-13(8)11/h1,4-5,8H,2-3,6-7H2/t8-/m0/s1

4.3 InChIKey

FIKUEZUFASUKAH-QMMMGPOBSA-N

4.4 Canonical SMILES

C1CC2COC3=C(C=CC=N3)C(=O)N2C1

4.5 Isomeric SMILES

C1C[C@H]2COC3=C(C=CC=N3)C(=O)N2C1

4.6 SDF file

Coming soon

5. Spectroscopic data

5.1 ¹³C nuclear magnetic resonance (¹³C NMR)

5.2 ¹H nuclear magnetic resonance (¹H NMR)

5.3 Mass spectrometry (MS)

Coming soon

5.4 Infrared spectroscopy (IR)

Coming soon

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

Coming soon

1. Primary Information

2. Suppliers & Pricing

3. Structures

3.1 2D structure

3.2 3D structure

4. International Nomenclature & Identifiers

4.1 IUPAC Name

4.2 InChI

4.3 InChIKey

4.4 Canonical SMILES

4.5 Isomeric SMILES

4.6 SDF file

5. Spectroscopic data

5.1 13C nuclear magnetic resonance (13C NMR)

5.2 1H nuclear magnetic resonance (1H NMR)

5.3 Mass spectrometry (MS)

5.4 Infrared spectroscopy (IR)

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

5.1 ¹³C nuclear magnetic resonance (¹³C NMR)

5.2 ¹H nuclear magnetic resonance (¹H NMR)