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Fmoc-3VVD-OH (Standard)

CAT: 0804-HY-78921R-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-78921R-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Fmoc-3VVD-OH (Standard) is the analytical standard of Fmoc-3VVD-OH. This product is intended for research and analytical applications. Fmoc-3VVD-OH is a cleavable ADC linker used in the synthesis of antibody-drug conjugates (ADCs).
CAS Number
863971-44-2
UNSPSC
12352005
Target
ADC Linker; Reference Standards
Related Pathways
Antibody-drug Conjugate/ADC Related; Others
Field of Research
Cancer
Purity
99.84
Smiles
CN([C@H]([C@H](OC)CC(O)=O)[C@@H](C)CC)C([C@H](C(C)C)NC([C@H](C(C)C)N(C(OCC1C2=C(C3=C1C=CC=C3)C=CC=C2)=O)C)=O)=O
Molecular Formula
C36H51N3O7
Molecular Weight
637.81
Shipping Conditions
Blue Ice
Storage Conditions
4°C, sealed storage, away from light and moisture
Scientific Category
Reference Standards
Clinical Information
No Development Reported

Chemical Information

(5S,8S,11S,12R)-11-((S)-sec-butyl)-1-(9H-fluoren-9-yl)-5,8-diisopropyl-12-methoxy-4,10-dimethyl-3,6,9-trioxo-2-oxa-4,7,10-triazatetradecan-14-oic acid
CAS Number863971-44-2
PubChem CID60042710
IUPAC Name(3R,4S,5S)-4-[[(2S)-2-[[(2S)-2-[9H-fluoren-9-ylmethoxycarbonyl(methyl)amino]-3-methylbutanoyl]amino]-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoic acid
Molecular FormulaC36H51N3O7
Molecular Weight637.8
XLogP6
Topological Polar Surface Area125
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count16
Heavy Atom Count46
Formal Charge0
Complexity1010
SMILES
CC[C@H](C)[C@@H]([C@@H](CC(=O)O)OC)N(C)C(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)N(C)C(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
InChI
InChI=1S/C36H51N3O7/c1-10-23(6)33(29(45-9)19-30(40)41)38(7)35(43)31(21(2)3)37-34(42)32(22(4)5)39(8)36(44)46-20-28-26-17-13-11-15-24(26)25-16-12-14-18-27(25)28/h11-18,21-23,28-29,31-33H,10,19-20H2,1-9H3,(H,37,42)(H,40,41)/t23-,29+,31-,32-,33-/m0/s1
InChIKey
SMVBIYSFDNRJJI-FCUBIXSHSA-N
Chemical Structure
2D Structure
2D structure of (5S,8S,11S,12R)-11-((S)-sec-butyl)-1-(9H-fluoren-9-yl)-5,8-diisopropyl-12-methoxy-4,10-dimethyl-3,6,9-trioxo-2-oxa-4,7,10-triazatetradecan-14-oic acid
CAS: 863971-44-2
CID: 60042710
Formula: C36H51N3O7
MW: 637.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight637.8
XLogP36
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count16
Exact Mass637.37270097
Monoisotopic Mass637.37270097
Topological Polar Surface Area125 Ų
Heavy Atom Count46
Formal Charge0
Complexity1010
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
50227-250MB3710, Standard Mixed Bed Resin, H/OH Form
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M24864-01FMOC-3VVD-OH
T210584-01Fmoc-3VVD-OH-d8
A7928-25000Fmoc-Lys(Fmoc)-OH
5-04729Fmoc-Dab(Fmoc)-OH
4018519.0025Fmoc-Orn (Fmoc) -OH
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