Products for Research Use Only
RegisterLogin

LacNAc-VC-PAB-MMAE

CAT: 0804-HY-176559Size: 1 EachDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0804-HY-176559Size:1 Each
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
2823367-88-8

Chemical Information

LacNAc-VC-PAB-MMAE
CAS Number2823367-88-8
PubChem CID177806058
IUPAC Name[4-[[(2S)-2-[[(2S)-2-[[2-[(E)-[(2R,3R,4S,5R,6S)-6-[[(3aR,5R,6S,7R,7aR)-7-hydroxy-5-(hydroxymethyl)-2-methyl-5,6,7,7a-tetrahydro-3aH-pyrano[3,2-d][1,3]oxazol-6-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methylideneamino]oxyacetyl]amino]-3-methylbutanoyl]amino]-5-(carbamoylamino)pentanoyl]amino]phenyl]methyl N-[(2S)-1-[[(2S)-1-[[(3R,4S,5S)-1-[(2S)-2-[(1R,2R)-3-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl]-3-methoxy-5-methyl-1-oxoheptan-4-yl]-methylamino]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-N-methylcarbamate
Molecular FormulaC74H116N12O23
Molecular Weight1541.8
XLogP0.8
Topological Polar Surface Area481
Hydrogen Bond Donor Count13
Hydrogen Bond Acceptor Count25
Rotatable Bond Count40
Heavy Atom Count109
Formal Charge0
Complexity3010
SMILES
CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@@H]([C@@H](C)C(=O)N[C@H](C)[C@H](C2=CC=CC=C2)O)OC)OC)N(C)C(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)N(C)C(=O)OCC3=CC=C(C=C3)NC(=O)[C@H](CCCNC(=O)N)NC(=O)[C@H](C(C)C)NC(=O)CO/N=C/[C@@H]4[C@@H]([C@@H]([C@H]([C@@H](O4)O[C@@H]5[C@H](O[C@H]6[C@@H]([C@H]5O)N=C(O6)C)CO)O)O)O
InChI
InChI=1S/C74H116N12O23/c1-16-40(8)58(49(102-14)32-53(89)86-31-21-25-48(86)64(103-15)41(9)66(95)78-42(10)59(90)45-22-18-17-19-23-45)84(12)70(99)55(38(4)5)83-69(98)57(39(6)7)85(13)74(101)104-35-44-26-28-46(29-27-44)80-67(96)47(24-20-30-76-73(75)100)81-68(97)54(37(2)3)82-52(88)36-105-77-33-50-60(91)62(93)63(94)72(107-50)109-65-51(34-87)108-71-56(61(65)92)79-43(11)106-71/h17-19,22-23,26-29,33,37-42,47-51,54-65,71-72,87,90-94H,16,20-21,24-25,30-32,34-36H2,1-15H3,(H,78,95)(H,80,96)(H,81,97)(H,82,88)(H,83,98)(H3,75,76,100)/b77-33+/t40-,41+,42+,47-,48-,49+,50+,51+,54-,55-,56+,57-,58-,59+,60-,61+,62-,63+,64+,65+,71-,72-/m0/s1
InChIKey
LRBGHRSPTRDWPJ-SHYZUCNHSA-N
Chemical Structure
2D Structure
2D structure of LacNAc-VC-PAB-MMAE
CAS: 2823367-88-8
CID: 177806058
Formula: C74H116N12O23
MW: 1541.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1541.8
XLogP30.8
Hydrogen Bond Donor Count13
Hydrogen Bond Acceptor Count25
Rotatable Bond Count40
Exact Mass1540.82762799
Monoisotopic Mass1540.82762799
Topological Polar Surface Area481 Ų
Heavy Atom Count109
Formal Charge0
Complexity3010
Isotope Atom Count0
Defined Atom Stereocenter Count22
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
HY-131056-01Gly3-VC-PAB-MMAE
HY-126681-01SC-VC-PAB-MMAE
HY-157544-01PC5-VC-PAB-MMAE
HY-148426-01OSu-PEG4-VC-PAB-MMAE
HY-100874-01N3-PEG3-vc-PAB-MMAE
HY-164239NH2-PEG3-VC-PAB-MMAE
HY-153428-01GGGDTDTC-Mc-vc-PAB-MMAE
HY-136314-01DBCO-PEG4-VC-PAB-MMAE
HY-141833-01Bi-Mc-VC-PAB-MMAE
HY-171822-01Cys-MC-VC-PAB-MMAE

Alternative Products

CatalogName
GTR19263843-01LacNAc-VC-PAB-MMAE
BA2658-10SC-VC-PAB-MMAE
BA2626-5PC5-VC-PAB-MMAE
T40308-01Gly3-VC-PAB-MMAE
ADC-S-012MC-vc-PAB-MMAE
GTR19248989-01MPB-VC-PAB-MMAE
ADC-S-007Vc-MMAE
BA2630-1DBCO-PEG4-VC-PAB-MMAE
T205780-01DBM (C6) -VC-PAB-MMAE
T88530-01NH2-PEG3-VC-PAB-MMAE

Popular Products