Kehua AI (Shenzhen) Innovative Drug R&D Co., Ltd.    Healthy Roots Biotechnology (Shenzhen) Co., Limited    Joint Development

1. Primary Information

English name: Collagenase I
CAS No.: 9001-12-1
Molecular formula: C60H100N2
Molecular weight: 849.4 g/mol
SMILES: CCCCCCCCC1CCC2(C1(CCC3(C2CCC4(C3(CC5=C(C4)N=C6CC7(C(CCC8C7(CCC9(C8(CCC9CCCCCCCC)C)C)C)(CC6=N5)C)C)C)C)C)C)C
Structural class:
Other identifiers:

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2. Suppliers & Pricing

Supplier Pack size Purity Price (CNY) Storage conditions Lead time Notes
Kehua Intelligence 100mg BR,Ⅰ型,>125CDU/mg 240 -20℃ in stock -
Kehua Intelligence 500mg BR,Ⅰ型,>125CDU/mg 880 -20℃ in stock -
Kehua Intelligence 1g BR,Ⅰ型,>125CDU/mg 1600 -20℃ in stock -
Kehua Intelligence 5g BR,Ⅰ型,>125CDU/mg 6400 -20℃ in stock -
Kehua Intelligence 100mg BR,Ⅱ型,>125CDU/mg 240 -20℃ in stock -
Kehua Intelligence 500mg BR,Ⅱ型,>125CDU/mg 880 -20℃ in stock -
Kehua Intelligence 1g BR,Ⅱ型,>125CDU/mg 1600 -20℃ in stock -
Kehua Intelligence 100mg BR,III型,>125CDU/mg 400 -20℃ in stock -
Kehua Intelligence 500mg BR,III型,>125CDU/mg 1760 -20℃ in stock -
Kehua Intelligence 100mg BR,Ⅳ型,≥125CDU/mg 240 -20℃ in stock -
Kehua Intelligence 500mg BR,Ⅳ型,≥125CDU/mg 960 -20℃ in stock -
Kehua Intelligence 1g BR,Ⅳ型,≥125CDU/mg 1760 -20℃ in stock -
Kehua Intelligence 100mg BR,Ⅴ型,>125CDU/mg 320 -20℃ in stock -
Kehua Intelligence 500mg BR,Ⅴ型,>125CDU/mg 1280 -20℃ in stock -
Kehua Intelligence 25mg BR,IA型,>125CDU/mg 372 -20℃ in stock -
Kehua Intelligence 250mg BR,IA型,>125CDU/mg 2240 -20℃ in stock -

3. Structures

3.1 2D structure


3.2 3D structure

Coming soon

4. International Nomenclature & Identifiers

4.1 IUPAC Name

(5S,6S,9R,10S,13S,17S,23S,24S,27R,28S,31S,35S)-5,6,9,13,17,23,24,27,31,35-decamethyl-10,28-dioctyl-2,20-diazanonacyclo[19.15.0.03,19.05,17.06,14.09,13.023,35.024,32.027,31]hexatriaconta-1(21),2,19-triene


4.2 InChI

InChI=1S/C60H100N2/c1-13-15-17-19-21-23-25-43-27-33-55(7)49-29-31-51(3)39-45-47(41-59(51,11)57(49,9)37-35-53(43,55)5)61-46-40-52(4)32-30-50-56(8)34-28-44(26-24-22-20-18-16-14-2)54(56,6)36-38-58(50,10)60(52,12)42-48(46)62-45/h43-44,49-50H,13-42H2,1-12H3/t43-,44-,49?,50?,51-,52-,53+,54+,55-,56-,57-,58-,59-,60-/m0/s1


4.3 InChIKey

YRQNKMKHABXEJZ-UVQQGXFZSA-N


4.4 Canonical SMILES

CCCCCCCCC1CCC2(C1(CCC3(C2CCC4(C3(CC5=C(C4)N=C6CC7(C(CCC8C7(CCC9(C8(CCC9CCCCCCCC)C)C)C)(CC6=N5)C)C)C)C)C)C)C


4.5 Isomeric SMILES

CCCCCCCC[C@H]1CC[C@@]2([C@@]1(CC[C@]3(C2CC[C@@]4([C@@]3(CC5=C(C4)N=C6C[C@]7([C@@](CCC8[C@@]7(CC[C@]9([C@]8(CC[C@@H]9CCCCCCCC)C)C)C)(CC6=N5)C)C)C)C)C)C)C

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
-- No 3D model data available --